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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2005-11-16 15:48:42 UTC
Update Date2021-09-14 15:47:38 UTC
HMDB IDHMDB0001178
Secondary Accession Numbers
  • HMDB01178
Metabolite Identification
Common NameAdenosine diphosphate ribose
DescriptionAdenosine diphosphate ribose is a molecule formed into poly(ADP-ribose) or PAR chains by the enzyme poly ADP ribose polymerase or PARP. PARP is found in every cell nucleus. Its main role is to detect and signal single-strand DNA breaks (SSB) to the enzymatic machinery involved in the SSB repair. PARP activation is an immediate cellular response to metabolic, chemical, or radiation-induced DNA SSB damage. Once PARP detects a SSB, it binds to the DNA, and, after a structural change, begins the synthesis of a poly (ADP-ribose) chain (PAR) as a signal for the other DNA-repairing enzymes such as DNA ligase III (LigIII), DNA polymerase beta, and scaffolding proteins such as X-ray cross-complementing gene 1 (XRCC1). After repairing, the PAR chains are degraded via PAR glycohydrolase (PARG). ADP-ribose binds to and activates the TRPM2 ion channel. Adenosine diphosphate ribose is an intermediate in NAD metabolism. The enzyme NAD(P)+ nucleosidase [EC:3.2.2.6] catalyzes the production of this metabolite from nicotinamide adenine dinucleotide phosphate. This reaction is irreversible and occurs in the cytosol.
Structure
Data?1582752182
Synonyms
ValueSource
Adenosine diphosphoric acid riboseGenerator
(Rib5)ppaHMDB
5-(Adenosine 5'-pyrophosphoryl)-D-riboseHMDB
a5'pp5RIbHMDB
Adenosine 5'-diphosphoriboseHMDB
AdoPPRibHMDB
ADP RiboseHMDB
ADP-D-RiboseHMDB
ADP-RibHMDB
ADP-RiboseHMDB
ADPriboseHMDB
D-Ribofuranos-5-yl-ADPHMDB
Ribose adenosine diphosphateHMDB
[5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[(3,4,5-trihydroxyoxolan-2-yl)methoxy]phosphoryl] hydrogen phosphateHMDB
Diphosphate ribose, adenosineHMDB
5'-Diphosphoribose, adenosineHMDB
Adenosine diphosphoriboseHMDB
Diphosphoribose, adenosineHMDB
Adenosine 5' diphosphoriboseHMDB
Ribose, ADPHMDB
Ribose, adenosine diphosphateHMDB
Chemical FormulaC15H23N5O14P2
Average Molecular Weight559.3157
Monoisotopic Molecular Weight559.071673493
IUPAC Name{[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({hydroxy[(3,4,5-trihydroxyoxolan-2-yl)methoxy]phosphoryl}oxy)phosphinic acid
Traditional Nameadp ribose
CAS Registry Number20762-30-5
SMILES
NC1=C2N=CN(C3OC(COP(O)(=O)OP(O)(=O)OCC4OC(O)C(O)C4O)C(O)C3O)C2=NC=N1
InChI Identifier
InChI=1S/C15H23N5O14P2/c16-12-7-13(18-3-17-12)20(4-19-7)14-10(23)8(21)5(32-14)1-30-35(26,27)34-36(28,29)31-2-6-9(22)11(24)15(25)33-6/h3-6,8-11,14-15,21-25H,1-2H2,(H,26,27)(H,28,29)(H2,16,17,18)
InChI KeySRNWOUGRCWSEMX-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as purine nucleotide sugars. These are purine nucleotides bound to a saccharide derivative through the terminal phosphate group.
KingdomOrganic compounds
Super ClassNucleosides, nucleotides, and analogues
ClassPurine nucleotides
Sub ClassPurine nucleotide sugars
Direct ParentPurine nucleotide sugars
Alternative Parents
Substituents
  • Purine nucleotide sugar
  • Purine ribonucleoside diphosphate
  • Purine ribonucleoside monophosphate
  • Pentose phosphate
  • Pentose-5-phosphate
  • Glycosyl compound
  • N-glycosyl compound
  • 6-aminopurine
  • Monosaccharide phosphate
  • Organic pyrophosphate
  • Imidazopyrimidine
  • Purine
  • Aminopyrimidine
  • Monoalkyl phosphate
  • Pyrimidine
  • Alkyl phosphate
  • Imidolactam
  • Phosphoric acid ester
  • Monosaccharide
  • N-substituted imidazole
  • Organic phosphoric acid derivative
  • Tetrahydrofuran
  • Azole
  • Imidazole
  • Heteroaromatic compound
  • Secondary alcohol
  • Hemiacetal
  • Organoheterocyclic compound
  • Polyol
  • Azacycle
  • Oxacycle
  • Organic oxide
  • Amine
  • Alcohol
  • Organopnictogen compound
  • Organic oxygen compound
  • Primary amine
  • Hydrocarbon derivative
  • Organic nitrogen compound
  • Organooxygen compound
  • Organonitrogen compound
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External DescriptorsNot Available
Ontology
Physiological effect

Adverse health effect

Disposition

Biological location

Source

Route of exposure

Process

Naturally occurring process

Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic Properties

Experimental Collision Cross Sections

Adduct TypeData SourceCCS Value (Å2)Reference
[M-H]-Not Available202.7http://allccs.zhulab.cn/database/detail?ID=AllCCS00000160
[M+H]+Not Available212.089http://allccs.zhulab.cn/database/detail?ID=AllCCS00000160
Predicted Molecular Properties
PropertyValueSource
Water Solubility3.61 g/LALOGPS
logP10(-1.8) g/LALOGPS
logP10(-6.7) g/LChemAxon
logS10(-2.2) g/LALOGPS
pKa (Strongest Acidic)1.86ChemAxon
pKa (Strongest Basic)5ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count15ChemAxon
Hydrogen Donor Count8ChemAxon
Polar Surface Area291.52 ŲChemAxon
Rotatable Bond Count9ChemAxon
Refractivity111.12 m³·mol⁻¹ChemAxon
Polarizability46.75 ųChemAxon
Number of Rings4ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+221.82231661259
DarkChem[M-H]-207.15131661259
AllCCS[M+H]+214.81632859911
AllCCS[M-H]-205.2732859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Adenosine diphosphate riboseNC1=C2N=CN(C3OC(COP(O)(=O)OP(O)(=O)OCC4OC(O)C(O)C4O)C(O)C3O)C2=NC=N14723.9Standard polar33892256
Adenosine diphosphate riboseNC1=C2N=CN(C3OC(COP(O)(=O)OP(O)(=O)OCC4OC(O)C(O)C4O)C(O)C3O)C2=NC=N12992.0Standard non polar33892256
Adenosine diphosphate riboseNC1=C2N=CN(C3OC(COP(O)(=O)OP(O)(=O)OCC4OC(O)C(O)C4O)C(O)C3O)C2=NC=N14834.2Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Adenosine diphosphate ribose,1TMS,isomer #1C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O4686.2Semi standard non polar33892256
Adenosine diphosphate ribose,1TMS,isomer #2C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C1O4656.8Semi standard non polar33892256
Adenosine diphosphate ribose,1TMS,isomer #3C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)OC(O)C1O4658.5Semi standard non polar33892256
Adenosine diphosphate ribose,1TMS,isomer #4C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N)N=CN=C32)C1O4656.1Semi standard non polar33892256
Adenosine diphosphate ribose,1TMS,isomer #5C[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N)N=CN=C214650.4Semi standard non polar33892256
Adenosine diphosphate ribose,1TMS,isomer #6C[Si](C)(C)OP(=O)(OCC1OC(N2C=NC3=C(N)N=CN=C32)C(O)C1O)OP(=O)(O)OCC1OC(O)C(O)C1O4712.6Semi standard non polar33892256
Adenosine diphosphate ribose,1TMS,isomer #7C[Si](C)(C)OP(=O)(OCC1OC(O)C(O)C1O)OP(=O)(O)OCC1OC(N2C=NC3=C(N)N=CN=C32)C(O)C1O4712.6Semi standard non polar33892256
Adenosine diphosphate ribose,1TMS,isomer #8C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O4711.2Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #1C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O)C1O4548.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #10C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C1O[Si](C)(C)C4525.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #11C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C1O4573.3Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #12C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C1O4573.3Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #13C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O)C1O4591.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #14C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)OC(O)C1O4520.6Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #15C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)OC(O)C1O4527.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #16C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)OC(O)C1O4580.6Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #16C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)OC(O)C1O4354.5Standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #16C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)OC(O)C1O7861.6Standard polar33892256
Adenosine diphosphate ribose,2TMS,isomer #17C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)OC(O)C1O4580.2Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #18C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C)C(O)C1O4593.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #19C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C4549.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #2C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O)C1O4555.8Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #20C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N)N=CN=C32)C1O4584.4Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #21C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O4583.4Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #22C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O[Si](C)(C)C)C1O4600.0Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #23C[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N)N=CN=C214575.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #24C[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC1N1C=NC2=C(N)N=CN=C214576.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #25C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O[Si](C)(C)C4590.8Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #26C[Si](C)(C)OP(=O)(OCC1OC(O)C(O)C1O)OP(=O)(OCC1OC(N2C=NC3=C(N)N=CN=C32)C(O)C1O)O[Si](C)(C)C4620.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #27C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O4648.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #28C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O)C1O4649.1Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #29C[Si](C)(C)N(C1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O)[Si](C)(C)C4682.3Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #3C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O[Si](C)(C)C)C1O4542.8Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #4C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O[Si](C)(C)C4556.1Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #5C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O4599.6Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #6C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O)C1O4599.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #7C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O)C(O)C1O4621.6Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #8C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C1O4518.2Semi standard non polar33892256
Adenosine diphosphate ribose,2TMS,isomer #9C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C1O4525.3Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #1C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4439.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #1C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4105.2Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #1C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O7528.4Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #10C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4460.4Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #11C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1O4508.0Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #12C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4418.2Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #13C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O[Si](C)(C)C)C1O4447.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #14C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4444.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #15C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1O4488.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #16C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O[Si](C)(C)C4455.4Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #17C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4452.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #18C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4499.4Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #18C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4242.5Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #18C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O7496.4Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #19C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O)C1O4500.9Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #2C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4410.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #2C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4095.6Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #2C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O7513.3Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #20C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O)C2O)O[Si](C)(C)C)C(O)C1O4551.1Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #21C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O)C(O)C1O4551.3Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #22C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)C(O)C1O4585.1Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #23C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O4408.0Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #23C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O4120.7Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #23C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O7533.7Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #24C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C4391.9Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #25C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C1O4419.8Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #26C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C1O4419.8Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #27C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4466.4Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #28C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O4399.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #29C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C1O4426.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #29C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C1O4230.1Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #29C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C1O7364.9Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #3C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4417.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #30C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C1O4430.0Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #31C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4472.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #32C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C1O[Si](C)(C)C4431.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #33C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C1O[Si](C)(C)C4429.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #34C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4486.1Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #35C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C1O4471.9Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #36C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O4514.9Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #37C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O)C1O4515.2Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #38C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)C1O4528.3Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #39C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(O)C1O4412.8Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #39C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(O)C1O4118.8Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #39C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(O)C1O7539.0Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #4C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O)C1O4451.3Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #40C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)OC(O)C1O4425.2Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #40C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)OC(O)C1O4232.7Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #40C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)OC(O)C1O7379.2Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #41C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)OC(O)C1O4424.9Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #42C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4467.9Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #43C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)OC(O)C1O4433.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #44C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)OC(O)C1O4435.1Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #45C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4475.0Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #46C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)OC(O)C1O4482.8Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #46C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)OC(O)C1O4390.8Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #46C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)OC(O)C1O7186.9Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #47C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4520.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #48C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C)C(O)C1O4520.5Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #49C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)OC(O)C1O4533.5Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #5C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O4450.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #50C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C4467.4Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #51C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C4464.3Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #51C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C4218.4Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #51C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C7381.5Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #52C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4516.2Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #53C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O4490.2Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #54C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O[Si](C)(C)C)C1O4533.4Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #55C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4532.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #56C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C1O4546.1Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #57C[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC1N1C=NC2=C(N)N=CN=C214483.1Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #58C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O[Si](C)(C)C4527.1Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #59C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4527.7Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #6C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O)C(O)C1O[Si](C)(C)C4502.3Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #60C[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C214539.3Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #60C[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C214430.2Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #60C[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C217439.1Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #61C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O)C1O4581.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #61C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O)C1O4559.3Standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #61C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O)C1O6975.1Standard polar33892256
Adenosine diphosphate ribose,3TMS,isomer #62C[Si](C)(C)OP(=O)(OCC1OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C(O)C1O)OP(=O)(O)OCC1OC(O)C(O)C1O4605.9Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #63C[Si](C)(C)OP(=O)(OCC1OC(O)C(O)C1O)OP(=O)(O)OCC1OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C(O)C1O4607.5Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #7C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4418.5Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #8C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4424.6Semi standard non polar33892256
Adenosine diphosphate ribose,3TMS,isomer #9C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O)C1O4458.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #1C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4312.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #10C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4328.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #11C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4328.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #12C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4397.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #13C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O4360.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #13C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O4250.0Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #13C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O6842.4Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #14C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O)C2O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4440.0Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #15C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O)C(O)C1O[Si](C)(C)C4439.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #16C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O)C1O4444.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #17C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4314.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #18C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4326.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #19C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4328.0Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #2C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4325.1Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #20C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4388.1Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #21C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4336.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #22C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4339.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #23C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4402.1Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #24C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4372.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #25C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4443.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #26C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1O4445.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #27C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O[Si](C)(C)C)C(O)C1O4451.0Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #28C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4338.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #29C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4335.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #3C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4352.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #30C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4413.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #31C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4353.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #32C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4425.4Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #33C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1O4423.0Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #34C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)C(O[Si](C)(C)C)C1O4431.4Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #35C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4365.0Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #36C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O4437.1Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #36C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O4285.5Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #36C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O6860.3Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #37C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4436.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #37C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4284.4Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #37C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O6860.3Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #38C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)C(O)C1O[Si](C)(C)C4449.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #39C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O[Si](C)(C)C)C(O)C2O)O[Si](C)(C)C)C(O)C1O4485.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #4C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4355.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #4C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4124.5Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #4C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O7022.1Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #40C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)C(O)C1O4496.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #41C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C(O)C1O4496.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #42C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O[Si](C)(C)C4305.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #43C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O4322.4Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #44C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C1O4327.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #44C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C1O4145.4Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #44C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C1O7029.4Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #45C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4400.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #46C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C1O[Si](C)(C)C4307.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #47C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C1O[Si](C)(C)C4306.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #48C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4381.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #49C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C1O4329.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #5C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4432.3Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #50C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4404.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #51C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4406.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #51C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4312.7Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #51C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C6888.5Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #52C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O[Si](C)(C)C)C2O)C1O4402.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #53C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O4318.3Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #54C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O4315.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #55C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4387.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #56C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C1O4341.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #56C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C1O4260.2Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #56C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C1O6839.4Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #57C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4408.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #58C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4413.3Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #59C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O[Si](C)(C)C)C1O4410.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #6C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4310.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #60C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C1O[Si](C)(C)C4342.4Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #61C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4424.3Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #62C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4421.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #63C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)C1O[Si](C)(C)C4429.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #64C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O)C1O4451.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #65C[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)C1O4450.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #66C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C1O4450.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #66C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C1O4486.2Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #66C[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)O[Si](C)(C)C)C1O6767.6Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #67C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(O)C1O4329.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #68C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)OC(O)C1O4331.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #69C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4404.3Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #7C[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4318.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #70C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)OC(O)C1O4338.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #71C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4410.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #72C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4411.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #73C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O[Si](C)(C)C)C2O)OC(O)C1O4403.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #74C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)OC(O)C1O4351.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #75C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4415.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #75C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4304.1Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #75C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O6850.9Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #76C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4418.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #77C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O[Si](C)(C)C)OC(O)C1O4411.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #78C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C(O)C1O4458.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #79C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)OC(O)C1O4454.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #8C[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4315.8Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #80C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C43)C(O)C2O)O[Si](C)(C)C)OC(O)C1O4452.5Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #81C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C4387.0Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #81C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C4249.2Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #81C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C6851.4Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #82C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4457.3Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #83C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4454.4Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #83C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4296.2Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #83C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C6841.5Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #84C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C1O[Si](C)(C)C4459.6Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #85C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4476.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #86C[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C1O4478.2Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #87C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C1O4473.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #87C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C1O4460.4Standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #87C[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C1O6742.1Standard polar33892256
Adenosine diphosphate ribose,4TMS,isomer #88C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4470.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #89C[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C214471.7Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #9C[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4383.9Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #90C[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C)OC1N1C=NC2=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C214469.3Semi standard non polar33892256
Adenosine diphosphate ribose,4TMS,isomer #91C[Si](C)(C)OP(=O)(OCC1OC(O)C(O)C1O)OP(=O)(OCC1OC(N2C=NC3=C(N([Si](C)(C)C)[Si](C)(C)C)N=CN=C32)C(O)C1O)O[Si](C)(C)C4526.1Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O4922.8Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C1O4900.6Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)OC(O)C1O4902.5Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N)N=CN=C32)C1O4899.7Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N)N=CN=C214896.3Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(N2C=NC3=C(N)N=CN=C32)C(O)C1O)OP(=O)(O)OCC1OC(O)C(O)C1O4920.5Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(O)C(O)C1O)OP(=O)(O)OCC1OC(N2C=NC3=C(N)N=CN=C32)C(O)C1O4921.2Semi standard non polar33892256
Adenosine diphosphate ribose,1TBDMS,isomer #8CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O4920.4Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O5017.1Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C1O[Si](C)(C)C(C)(C)C4985.8Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC1C(O)OC(COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C1O4995.1Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C(C)(C)C)C1O4995.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O5006.6Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C(C)(C)C)C2O)OC(O)C1O4989.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C(C)(C)C)OC(O)C1O4991.8Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)OC(O)C1O5002.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C(C)(C)C)OC(O)C1O5003.4Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1O5008.8Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N)N=CN=C32)C1O[Si](C)(C)C(C)(C)C5013.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1O5019.8Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)OC(N2C=NC3=C(N)N=CN=C32)C1O5012.2Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C(C)(C)C)OC(N2C=NC3=C(N)N=CN=C32)C1O5010.3Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #22CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O5016.4Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1C(O)C(COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)OC1N1C=NC2=C(N)N=CN=C215007.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1C(O)C(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C(C)(C)C)OC1N1C=NC2=C(N)N=CN=C215007.4Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #25CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C5014.6Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #26CC(C)(C)[Si](C)(C)OP(=O)(OCC1OC(O)C(O)C1O)OP(=O)(OCC1OC(N2C=NC3=C(N)N=CN=C32)C(O)C1O)O[Si](C)(C)C(C)(C)C5028.1Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #27CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O5040.6Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #28CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(OCC2OC(O)C(O)C2O)O[Si](C)(C)C(C)(C)C)C(O)C1O5041.1Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #29CC(C)(C)[Si](C)(C)N(C1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O)C(O)C1O)[Si](C)(C)C(C)(C)C5028.9Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O5011.7Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C5018.2Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC1OC(COP(=O)(O[Si](C)(C)C(C)(C)C)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)C(O)C1O5018.5Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC1OC(COP(=O)(O)OP(=O)(OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O)O[Si](C)(C)C(C)(C)C)C(O)C1O5018.2Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)NC1=NC=NC2=C1N=CN2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1O5028.7Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O[Si](C)(C)C(C)(C)C)C2O)C1O4992.0Semi standard non polar33892256
Adenosine diphosphate ribose,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC1C(O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=NC4=C(N)N=CN=C43)C(O)C2O[Si](C)(C)C(C)(C)C)C1O4994.5Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (Non-derivatized) - 70eV, Positivesplash10-01r5-1196680000-fb6c20cc4fb54b50028e2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (1 TMS) - 70eV, Positivesplash10-01r5-2115904000-4597a65923641317c7912017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS ("Adenosine diphosphate ribose,1TMS,#1" TMS) - 70eV, PositiveNot Available2021-10-14Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_1_2) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_1_3) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_1_4) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_1_5) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_1_6) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_1_7) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_1_8) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_1) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_2) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_3) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_4) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_5) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_6) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_7) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_8) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_9) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_10) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_11) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_12) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_13) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_14) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Adenosine diphosphate ribose GC-MS (TMS_2_15) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 10V, Negative-QTOFsplash10-0a59-1701390000-e958d4521e35989750e12016-09-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 20V, Negative-QTOFsplash10-001i-1910100000-a653cbe7cba6b5fab2342016-09-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 40V, Negative-QTOFsplash10-0a7i-3900000000-c8a10ccf06e1cb8b548a2016-09-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 10V, Negative-QTOFsplash10-0a4i-0000290000-f9ecd49245b2df56a8de2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 20V, Negative-QTOFsplash10-0ar0-1221970000-04d99933f777218ddd3c2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 40V, Negative-QTOFsplash10-0a6v-5932310000-f0d589f4eccb4121906e2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 10V, Positive-QTOFsplash10-000i-0910130000-b9073b1bbcee0d4c7c6e2016-09-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 20V, Positive-QTOFsplash10-000i-0910000000-4407a7719b31b18bb57b2016-09-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 40V, Positive-QTOFsplash10-000i-1900000000-9d6c2b567f9da9d1d1ce2016-09-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 10V, Positive-QTOFsplash10-03di-0000090000-36723dbc3777092ad5f22021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 20V, Positive-QTOFsplash10-0faa-2853950000-c2c9d5c0b802214dc6cc2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Adenosine diphosphate ribose 40V, Positive-QTOFsplash10-000i-2921100000-97be795a8dc0bb3af64e2021-09-24Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
  • Mitochondria
Biospecimen LocationsNot Available
Tissue Locations
  • Placenta
  • Prostate
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB022468
KNApSAcK IDNot Available
Chemspider ID187
KEGG Compound IDC00301
BioCyc IDNot Available
BiGG ID34547
Wikipedia LinkAdenosine diphosphate ribose
METLIN ID6059
PubChem Compound192
PDB IDNot Available
ChEBI ID16960
Food Biomarker OntologyNot Available
VMH IDADPRIB
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Hardie WD, Wright PE, Bernard GR: Effects of intravenous amphotericin B infusion on hemodynamics and airway mechanics in awake sheep. Chest. 1991 Feb;99(2):457-62. [PubMed:1989809 ]
  2. Garcia-Szabo R, Kern DF, Malik AB: Pulmonary vascular response to thrombin: effects of thromboxane synthetase inhibition with OKY-046 and OKY-1581. Prostaglandins. 1984 Dec;28(6):851-66. [PubMed:6543018 ]
  3. Vela-Navarrete R, Escribano-Burgos M, Farre AL, Garcia-Cardoso J, Manzarbeitia F, Carrasco C: Serenoa repens treatment modifies bax/bcl-2 index expression and caspase-3 activity in prostatic tissue from patients with benign prostatic hyperplasia. J Urol. 2005 Feb;173(2):507-10. [PubMed:15643230 ]
  4. Elshenawy S, Pinney SE, Stuart T, Doulias PT, Zura G, Parry S, Elovitz MA, Bennett MJ, Bansal A, Strauss JF 3rd, Ischiropoulos H, Simmons RA: The Metabolomic Signature of the Placenta in Spontaneous Preterm Birth. Int J Mol Sci. 2020 Feb 4;21(3). pii: ijms21031043. doi: 10.3390/ijms21031043. [PubMed:32033212 ]

Enzymes

General function:
Involved in hydrolase activity
Specific function:
Hydrolyzes with similar activities ADP-ribose ADP-mannose, ADP-glucose, 8-oxo-GDP and 8-oxo-dGDP. Can also hydrolyze other nucleotide sugars with low activity.
Gene Name:
NUDT5
Uniprot ID:
Q9UKK9
Molecular weight:
24327.41
Reactions
Adenosine diphosphate ribose + Water → Adenosine monophosphate + D-Ribose 5-phosphatedetails
Adenosine diphosphate ribose + Water → Adenosine monophosphate + D-Ribose 5-phosphatedetails
General function:
Involved in hydrolase activity
Specific function:
Hydrolyzes ADP-ribose (ADPR) to AMP and ribose 5'-phosphate.
Gene Name:
NUDT9
Uniprot ID:
Q9BW91
Molecular weight:
35448.725
Reactions
Adenosine diphosphate ribose + Water → Adenosine monophosphate + D-Ribose 5-phosphatedetails
Adenosine diphosphate ribose + Water → Adenosine monophosphate + D-Ribose 5-phosphatedetails
General function:
Involved in NAD+ nucleosidase activity
Specific function:
Synthesizes cyclic ADP-ribose, a second messenger that elicits calcium release from intracellular stores. May be involved in pre-B-cell growth.
Gene Name:
BST1
Uniprot ID:
Q10588
Molecular weight:
35723.545
Reactions
NAD + Water → Adenosine diphosphate ribose + Niacinamidedetails
General function:
Involved in NAD+ nucleosidase activity
Specific function:
Synthesizes cyclic ADP-ribose, a second messenger for glucose-induced insulin secretion. Also has cADPr hydrolase activity. Also moonlights as a receptor in cells of the immune system.
Gene Name:
CD38
Uniprot ID:
P28907
Molecular weight:
34328.145
Reactions
NAD + Water → Adenosine diphosphate ribose + Niacinamidedetails
General function:
Involved in ion channel activity
Specific function:
Nonselective, voltage-independent cation channel mediating sodium and calcium ion influx in response to oxidative stress. Extracellular calcium passes through the channel and acts from the intracellular side as a positive regulator in channel activation. Activated by ADP-ribose, nicotinamide adenine dinucleotide (NAD(+)), reactive nitrogen species and arachidonic acid. Inactivated by intracellular ATP. Confers susceptibility to cell death following oxidative stress. Isoform 2 does not seem to be regulated by ADPR. Has ADP-ribose pyrophosphatase activity.
Gene Name:
TRPM2
Uniprot ID:
O94759
Molecular weight:
171224.9
Reactions
Adenosine diphosphate ribose + Water → Adenosine monophosphate + D-Ribose 5-phosphatedetails
General function:
Involved in magnesium ion binding
Specific function:
Catalyzes the reverse reaction of mono-ADP-ribosylation.
Gene Name:
ADPRH
Uniprot ID:
P54922
Molecular weight:
39506.34
Reactions
Protein-N(omega)-(ADP-D-ribosyl)-L-arginine + Water → Adenosine diphosphate ribose + protein-L-argininedetails
ADP-Ribosyl-L-arginine + Water → Adenosine diphosphate ribose + L-Argininedetails
General function:
Not Available
Specific function:
Hydrolyzes ADP-ribose, IDP-ribose, CDP-glycerol, CDP-choline and CDP-ethanolamine, but not other non-reducing ADP-sugars or CDP-glucose. May be involved in immune cell signaling as suggested by the second-messenger role of ADP-ribose, which activates TRPM2 as a mediator of oxidative/nitrosative stress (By similarity).
Gene Name:
ADPRM
Uniprot ID:
Q3LIE5
Molecular weight:
39529.105
Reactions
Adenosine diphosphate ribose + Water → Adenosine monophosphate + D-Ribose 5-phosphatedetails
Adenosine diphosphate ribose + Water → Adenosine monophosphate + D-Ribose 5-phosphatedetails