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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 19:52:10 UTC
Update Date2022-03-07 02:54:17 UTC
HMDB IDHMDB0034938
Secondary Accession Numbers
  • HMDB34938
Metabolite Identification
Common NameCappariloside B
DescriptionCappariloside B belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Cappariloside B has been detected, but not quantified in, capers (Capparis spinosa) and herbs and spices. This could make cappariloside b a potential biomarker for the consumption of these foods. Based on a literature review a significant number of articles have been published on Cappariloside B.
Structure
Data?1563862638
SynonymsNot Available
Chemical FormulaC22H28N2O11
Average Molecular Weight496.4645
Monoisotopic Molecular Weight496.169309748
IUPAC Name2-(4-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H-indol-3-yl)acetonitrile
Traditional Name2-(4-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H-indol-3-yl)acetonitrile
CAS Registry Number229483-42-5
SMILES
OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4)C(O)C(O)C2O)C(O)C(O)C1O
InChI Identifier
InChI=1S/C22H28N2O11/c23-5-4-9-6-24-10-2-1-3-11(14(9)10)33-22-20(31)18(29)16(27)13(35-22)8-32-21-19(30)17(28)15(26)12(7-25)34-21/h1-3,6,12-13,15-22,24-31H,4,7-8H2
InChI KeyYWQNATCXFBWYHU-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose.
KingdomOrganic compounds
Super ClassOrganic oxygen compounds
ClassOrganooxygen compounds
Sub ClassCarbohydrates and carbohydrate conjugates
Direct ParentPhenolic glycosides
Alternative Parents
Substituents
  • Phenolic glycoside
  • Disaccharide
  • O-glycosyl compound
  • 3-alkylindole
  • Indole
  • Indole or derivatives
  • Oxane
  • Benzenoid
  • Substituted pyrrole
  • Heteroaromatic compound
  • Pyrrole
  • Secondary alcohol
  • Acetal
  • Carbonitrile
  • Nitrile
  • Oxacycle
  • Azacycle
  • Polyol
  • Organoheterocyclic compound
  • Organic nitrogen compound
  • Organonitrogen compound
  • Organopnictogen compound
  • Hydrocarbon derivative
  • Primary alcohol
  • Alcohol
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
Role
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water Solubility302700 mg/L @ 25 °C (est)The Good Scents Company Information System
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility12.5 g/LALOGPS
logP-0.68ALOGPS
logP-2.6ChemAxon
logS-1.6ALOGPS
pKa (Strongest Acidic)11.9ChemAxon
pKa (Strongest Basic)-3ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count12ChemAxon
Hydrogen Donor Count8ChemAxon
Polar Surface Area218.11 ŲChemAxon
Rotatable Bond Count7ChemAxon
Refractivity113.97 m³·mol⁻¹ChemAxon
Polarizability47.99 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]+207.14531661259
DarkChem[M-H]-201.65931661259
DeepCCS[M+H]+205.68630932474
DeepCCS[M-H]-203.32830932474
DeepCCS[M-2H]-236.54430932474
DeepCCS[M+Na]+211.88430932474
AllCCS[M+H]+211.632859911
AllCCS[M+H-H2O]+209.932859911
AllCCS[M+NH4]+213.132859911
AllCCS[M+Na]+213.632859911
AllCCS[M-H]-204.932859911
AllCCS[M+Na-2H]-205.832859911
AllCCS[M+HCOO]-206.932859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Cappariloside BOCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4)C(O)C(O)C2O)C(O)C(O)C1O4151.9Standard polar33892256
Cappariloside BOCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4)C(O)C(O)C2O)C(O)C(O)C1O4268.1Standard non polar33892256
Cappariloside BOCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4)C(O)C(O)C2O)C(O)C(O)C1O4754.1Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Cappariloside B,1TMS,isomer #1C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O)C1O4495.3Semi standard non polar33892256
Cappariloside B,1TMS,isomer #2C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O4508.9Semi standard non polar33892256
Cappariloside B,1TMS,isomer #3C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C1O4489.5Semi standard non polar33892256
Cappariloside B,1TMS,isomer #4C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4504.3Semi standard non polar33892256
Cappariloside B,1TMS,isomer #5C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)OC(CO)C(O)C1O4485.2Semi standard non polar33892256
Cappariloside B,1TMS,isomer #6C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C1O4459.6Semi standard non polar33892256
Cappariloside B,1TMS,isomer #7C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C1O4495.7Semi standard non polar33892256
Cappariloside B,1TMS,isomer #8C[Si](C)(C)N1C=C(CC#N)C2=C(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C=CC=C214522.3Semi standard non polar33892256
Cappariloside B,2TMS,isomer #1C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O4409.9Semi standard non polar33892256
Cappariloside B,2TMS,isomer #10C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(O)C1O4391.0Semi standard non polar33892256
Cappariloside B,2TMS,isomer #11C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O4403.6Semi standard non polar33892256
Cappariloside B,2TMS,isomer #12C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C4396.8Semi standard non polar33892256
Cappariloside B,2TMS,isomer #13C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O4438.5Semi standard non polar33892256
Cappariloside B,2TMS,isomer #14C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O[Si](C)(C)C4379.3Semi standard non polar33892256
Cappariloside B,2TMS,isomer #15C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O)C1O4374.3Semi standard non polar33892256
Cappariloside B,2TMS,isomer #16C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C1O4330.1Semi standard non polar33892256
Cappariloside B,2TMS,isomer #17C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O4357.5Semi standard non polar33892256
Cappariloside B,2TMS,isomer #18C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C1O4406.8Semi standard non polar33892256
Cappariloside B,2TMS,isomer #19C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O)C1O4402.1Semi standard non polar33892256
Cappariloside B,2TMS,isomer #2C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O4380.2Semi standard non polar33892256
Cappariloside B,2TMS,isomer #20C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4358.7Semi standard non polar33892256
Cappariloside B,2TMS,isomer #21C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4384.8Semi standard non polar33892256
Cappariloside B,2TMS,isomer #22C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O4426.1Semi standard non polar33892256
Cappariloside B,2TMS,isomer #23C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C)C1O4363.5Semi standard non polar33892256
Cappariloside B,2TMS,isomer #24C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C4365.2Semi standard non polar33892256
Cappariloside B,2TMS,isomer #25C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)OC(CO)C(O)C1O4390.3Semi standard non polar33892256
Cappariloside B,2TMS,isomer #26C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C4356.6Semi standard non polar33892256
Cappariloside B,2TMS,isomer #27C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C1O4369.8Semi standard non polar33892256
Cappariloside B,2TMS,isomer #28C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O)C1O4414.9Semi standard non polar33892256
Cappariloside B,2TMS,isomer #3C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O4402.2Semi standard non polar33892256
Cappariloside B,2TMS,isomer #4C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O4389.6Semi standard non polar33892256
Cappariloside B,2TMS,isomer #5C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O4366.3Semi standard non polar33892256
Cappariloside B,2TMS,isomer #6C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C4403.8Semi standard non polar33892256
Cappariloside B,2TMS,isomer #7C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O4405.8Semi standard non polar33892256
Cappariloside B,2TMS,isomer #8C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O)C1O4408.0Semi standard non polar33892256
Cappariloside B,2TMS,isomer #9C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1O4363.2Semi standard non polar33892256
Cappariloside B,3TMS,isomer #1C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O4302.8Semi standard non polar33892256
Cappariloside B,3TMS,isomer #10C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C4268.6Semi standard non polar33892256
Cappariloside B,3TMS,isomer #11C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O4327.2Semi standard non polar33892256
Cappariloside B,3TMS,isomer #12C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4311.7Semi standard non polar33892256
Cappariloside B,3TMS,isomer #13C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4258.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #14C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4318.5Semi standard non polar33892256
Cappariloside B,3TMS,isomer #15C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O4357.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #16C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4276.4Semi standard non polar33892256
Cappariloside B,3TMS,isomer #17C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4284.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #18C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O4343.8Semi standard non polar33892256
Cappariloside B,3TMS,isomer #19C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4269.6Semi standard non polar33892256
Cappariloside B,3TMS,isomer #2C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O4309.6Semi standard non polar33892256
Cappariloside B,3TMS,isomer #20C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O4321.1Semi standard non polar33892256
Cappariloside B,3TMS,isomer #21C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C4356.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #22C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4312.2Semi standard non polar33892256
Cappariloside B,3TMS,isomer #23C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1O4319.7Semi standard non polar33892256
Cappariloside B,3TMS,isomer #24C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1O4304.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #25C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4290.4Semi standard non polar33892256
Cappariloside B,3TMS,isomer #26C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C1O4386.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #27C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4301.8Semi standard non polar33892256
Cappariloside B,3TMS,isomer #28C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O4255.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #29C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C1O4251.1Semi standard non polar33892256
Cappariloside B,3TMS,isomer #3C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O4325.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #30C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)OC(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1O4331.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #31C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O4301.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #32C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O4309.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #33C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(O)C1O4367.8Semi standard non polar33892256
Cappariloside B,3TMS,isomer #34C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O[Si](C)(C)C4338.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #35C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O[Si](C)(C)C)C1O4367.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #36C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C4361.7Semi standard non polar33892256
Cappariloside B,3TMS,isomer #37C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4286.8Semi standard non polar33892256
Cappariloside B,3TMS,isomer #38C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O4232.1Semi standard non polar33892256
Cappariloside B,3TMS,isomer #39C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O4274.7Semi standard non polar33892256
Cappariloside B,3TMS,isomer #4C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O4268.2Semi standard non polar33892256
Cappariloside B,3TMS,isomer #40C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O[Si](C)(C)C4336.0Semi standard non polar33892256
Cappariloside B,3TMS,isomer #41C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4237.5Semi standard non polar33892256
Cappariloside B,3TMS,isomer #42C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C1O4237.0Semi standard non polar33892256
Cappariloside B,3TMS,isomer #43C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C1O4337.7Semi standard non polar33892256
Cappariloside B,3TMS,isomer #44C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C1O4241.7Semi standard non polar33892256
Cappariloside B,3TMS,isomer #45C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C1O4282.6Semi standard non polar33892256
Cappariloside B,3TMS,isomer #46C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O4317.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #47C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4293.4Semi standard non polar33892256
Cappariloside B,3TMS,isomer #48C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4282.2Semi standard non polar33892256
Cappariloside B,3TMS,isomer #49C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C1O4376.2Semi standard non polar33892256
Cappariloside B,3TMS,isomer #5C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C4332.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #50C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4292.8Semi standard non polar33892256
Cappariloside B,3TMS,isomer #51C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O4318.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #52C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O4354.4Semi standard non polar33892256
Cappariloside B,3TMS,isomer #53C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4298.6Semi standard non polar33892256
Cappariloside B,3TMS,isomer #54C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C)C1O4327.9Semi standard non polar33892256
Cappariloside B,3TMS,isomer #55C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C4329.2Semi standard non polar33892256
Cappariloside B,3TMS,isomer #56C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C4322.3Semi standard non polar33892256
Cappariloside B,3TMS,isomer #6C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O4367.7Semi standard non polar33892256
Cappariloside B,3TMS,isomer #7C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O4280.5Semi standard non polar33892256
Cappariloside B,3TMS,isomer #8C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O4257.4Semi standard non polar33892256
Cappariloside B,3TMS,isomer #9C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O4212.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #1C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O4264.9Semi standard non polar33892256
Cappariloside B,4TMS,isomer #10C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4230.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #11C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4241.0Semi standard non polar33892256
Cappariloside B,4TMS,isomer #12C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O4294.4Semi standard non polar33892256
Cappariloside B,4TMS,isomer #13C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4223.0Semi standard non polar33892256
Cappariloside B,4TMS,isomer #14C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O4241.8Semi standard non polar33892256
Cappariloside B,4TMS,isomer #15C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C4308.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #16C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4207.8Semi standard non polar33892256
Cappariloside B,4TMS,isomer #17C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4160.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #18C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4214.0Semi standard non polar33892256
Cappariloside B,4TMS,isomer #19C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O4249.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #2C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O4232.6Semi standard non polar33892256
Cappariloside B,4TMS,isomer #20C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4165.4Semi standard non polar33892256
Cappariloside B,4TMS,isomer #21C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4164.8Semi standard non polar33892256
Cappariloside B,4TMS,isomer #22C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O4226.2Semi standard non polar33892256
Cappariloside B,4TMS,isomer #23C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4157.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #24C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O4172.9Semi standard non polar33892256
Cappariloside B,4TMS,isomer #25C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C4232.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #26C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4205.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #27C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4216.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #28C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4273.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #29C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4197.4Semi standard non polar33892256
Cappariloside B,4TMS,isomer #3C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O4179.5Semi standard non polar33892256
Cappariloside B,4TMS,isomer #30C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4218.6Semi standard non polar33892256
Cappariloside B,4TMS,isomer #31C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4285.2Semi standard non polar33892256
Cappariloside B,4TMS,isomer #32C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4237.5Semi standard non polar33892256
Cappariloside B,4TMS,isomer #33C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4251.4Semi standard non polar33892256
Cappariloside B,4TMS,isomer #34C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4262.2Semi standard non polar33892256
Cappariloside B,4TMS,isomer #35C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4241.2Semi standard non polar33892256
Cappariloside B,4TMS,isomer #36C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4278.4Semi standard non polar33892256
Cappariloside B,4TMS,isomer #37C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4222.9Semi standard non polar33892256
Cappariloside B,4TMS,isomer #38C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4217.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #39C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4285.0Semi standard non polar33892256
Cappariloside B,4TMS,isomer #4C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C4239.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #40C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4224.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #41C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O4220.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #42C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1O4290.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #43C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4252.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #44C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1O4269.4Semi standard non polar33892256
Cappariloside B,4TMS,isomer #45C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)OC(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O4258.8Semi standard non polar33892256
Cappariloside B,4TMS,isomer #46C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O4223.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #47C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O[Si](C)(C)C4222.2Semi standard non polar33892256
Cappariloside B,4TMS,isomer #48C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)OC(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4267.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #49C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O4216.9Semi standard non polar33892256
Cappariloside B,4TMS,isomer #5C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O4278.6Semi standard non polar33892256
Cappariloside B,4TMS,isomer #50C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O[Si](C)(C)C)C1O4228.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #51C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C1O4226.6Semi standard non polar33892256
Cappariloside B,4TMS,isomer #52C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O4266.2Semi standard non polar33892256
Cappariloside B,4TMS,isomer #53C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O4271.0Semi standard non polar33892256
Cappariloside B,4TMS,isomer #54C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O[Si](C)(C)C)C1O4274.5Semi standard non polar33892256
Cappariloside B,4TMS,isomer #55C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4317.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #56C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4198.7Semi standard non polar33892256
Cappariloside B,4TMS,isomer #57C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4196.9Semi standard non polar33892256
Cappariloside B,4TMS,isomer #58C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4257.9Semi standard non polar33892256
Cappariloside B,4TMS,isomer #59C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O[Si](C)(C)C4200.6Semi standard non polar33892256
Cappariloside B,4TMS,isomer #6C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4236.5Semi standard non polar33892256
Cappariloside B,4TMS,isomer #60C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O4200.2Semi standard non polar33892256
Cappariloside B,4TMS,isomer #61C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O4242.9Semi standard non polar33892256
Cappariloside B,4TMS,isomer #62C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C1O4196.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #63C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4206.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #64C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C1O4199.3Semi standard non polar33892256
Cappariloside B,4TMS,isomer #65C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C1O4204.8Semi standard non polar33892256
Cappariloside B,4TMS,isomer #66C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4236.0Semi standard non polar33892256
Cappariloside B,4TMS,isomer #67C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O4247.8Semi standard non polar33892256
Cappariloside B,4TMS,isomer #68C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O4237.4Semi standard non polar33892256
Cappariloside B,4TMS,isomer #69C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O4246.6Semi standard non polar33892256
Cappariloside B,4TMS,isomer #7C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4176.6Semi standard non polar33892256
Cappariloside B,4TMS,isomer #70C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4264.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #8C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4246.1Semi standard non polar33892256
Cappariloside B,4TMS,isomer #9C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O4282.1Semi standard non polar33892256
Cappariloside B,5TMS,isomer #1C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4191.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #10C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C4215.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #11C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4149.1Semi standard non polar33892256
Cappariloside B,5TMS,isomer #12C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4149.4Semi standard non polar33892256
Cappariloside B,5TMS,isomer #13C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4214.8Semi standard non polar33892256
Cappariloside B,5TMS,isomer #14C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4142.6Semi standard non polar33892256
Cappariloside B,5TMS,isomer #15C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4157.9Semi standard non polar33892256
Cappariloside B,5TMS,isomer #16C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4224.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #17C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4194.4Semi standard non polar33892256
Cappariloside B,5TMS,isomer #18C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4205.9Semi standard non polar33892256
Cappariloside B,5TMS,isomer #19C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4221.4Semi standard non polar33892256
Cappariloside B,5TMS,isomer #2C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4152.2Semi standard non polar33892256
Cappariloside B,5TMS,isomer #20C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4188.0Semi standard non polar33892256
Cappariloside B,5TMS,isomer #21C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4130.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #22C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4125.1Semi standard non polar33892256
Cappariloside B,5TMS,isomer #23C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4172.4Semi standard non polar33892256
Cappariloside B,5TMS,isomer #24C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4123.0Semi standard non polar33892256
Cappariloside B,5TMS,isomer #25C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4130.0Semi standard non polar33892256
Cappariloside B,5TMS,isomer #26C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4184.2Semi standard non polar33892256
Cappariloside B,5TMS,isomer #27C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4133.9Semi standard non polar33892256
Cappariloside B,5TMS,isomer #28C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4141.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #29C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4147.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #3C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4200.2Semi standard non polar33892256
Cappariloside B,5TMS,isomer #30C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4128.6Semi standard non polar33892256
Cappariloside B,5TMS,isomer #31C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4170.2Semi standard non polar33892256
Cappariloside B,5TMS,isomer #32C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4177.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #33C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4191.0Semi standard non polar33892256
Cappariloside B,5TMS,isomer #34C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4163.2Semi standard non polar33892256
Cappariloside B,5TMS,isomer #35C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4229.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #36C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4186.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #37C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4181.7Semi standard non polar33892256
Cappariloside B,5TMS,isomer #38C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4252.2Semi standard non polar33892256
Cappariloside B,5TMS,isomer #39C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4178.7Semi standard non polar33892256
Cappariloside B,5TMS,isomer #4C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O4246.7Semi standard non polar33892256
Cappariloside B,5TMS,isomer #40C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O4182.0Semi standard non polar33892256
Cappariloside B,5TMS,isomer #41C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C4178.7Semi standard non polar33892256
Cappariloside B,5TMS,isomer #42C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O4172.6Semi standard non polar33892256
Cappariloside B,5TMS,isomer #43C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4182.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #44C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O[Si](C)(C)C)C1O4180.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #45C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)OC(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O4217.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #46C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C)C1O[Si](C)(C)C4186.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #47C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O[Si](C)(C)C)C1O4182.1Semi standard non polar33892256
Cappariloside B,5TMS,isomer #48C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O[Si](C)(C)C4182.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #49C[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O4186.2Semi standard non polar33892256
Cappariloside B,5TMS,isomer #5C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4154.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #50C[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O4234.6Semi standard non polar33892256
Cappariloside B,5TMS,isomer #51C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O[Si](C)(C)C4148.1Semi standard non polar33892256
Cappariloside B,5TMS,isomer #52C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4153.6Semi standard non polar33892256
Cappariloside B,5TMS,isomer #53C[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4150.8Semi standard non polar33892256
Cappariloside B,5TMS,isomer #54C[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O[Si](C)(C)C4154.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #55C[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C1O4156.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #56C[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C)C(O)C1O4192.6Semi standard non polar33892256
Cappariloside B,5TMS,isomer #6C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4151.7Semi standard non polar33892256
Cappariloside B,5TMS,isomer #7C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O4206.3Semi standard non polar33892256
Cappariloside B,5TMS,isomer #8C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4142.5Semi standard non polar33892256
Cappariloside B,5TMS,isomer #9C[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O4155.2Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O)C1O4707.6Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O4738.1Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C1O4725.5Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4731.2Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)OC(CO)C(O)C1O4716.3Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C1O4707.4Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C1O4727.7Semi standard non polar33892256
Cappariloside B,1TBDMS,isomer #8CC(C)(C)[Si](C)(C)N1C=C(CC#N)C2=C(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C=CC=C214778.3Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O4810.4Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)OC(CO)C(O)C1O4789.6Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C(C)(C)C)C1O4819.0Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C4828.6Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O4876.9Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O[Si](C)(C)C(C)(C)C4818.3Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O4808.3Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C1O4780.5Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(O)C1O4773.7Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)C1O4854.2Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1O4812.3Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O4797.4Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4781.6Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4782.2Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)C(O)C1O4865.0Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O4781.9Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C4794.2Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)OC(CO)C(O)C1O4825.2Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C4782.7Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C1O4811.6Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O)C1O4854.8Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4804.3Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4787.5Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4787.5Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4806.6Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O4826.5Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1O4816.3Semi standard non polar33892256
Cappariloside B,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O4779.4Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O4910.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4883.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O4914.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4877.4Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4872.9Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4898.4Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4922.3Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4885.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4883.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4908.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4879.1Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4906.5Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4904.4Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4928.8Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O4921.1Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1O4907.6Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O4874.7Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O4877.6Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1O4953.3Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=C[NH]3)OC(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C1O4888.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C(C)(C)C)C1O4879.8Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #29CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C1O4894.1Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4887.1Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #30CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)OC(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O4906.6Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #31CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(O)C1O4892.4Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #32CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C(C)(C)C)C1O4878.8Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #33CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)OC(CO)C(O)C1O4922.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #34CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4940.5Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4953.3Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #36CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)OC(COC2OC(CO)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C4966.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #37CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C1O4905.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #38CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C1O4883.7Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #39CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O4876.5Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4874.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #40CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4944.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #41CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C1O4872.6Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #42CC(C)(C)[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C1O4883.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #43CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O4936.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #44CC(C)(C)[Si](C)(C)OC1C(O)C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C1O4888.7Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #45CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C1O4898.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #46CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(O)C1O4901.8Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #47CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4869.9Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #48CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4877.5Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #49CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1O4945.1Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4908.3Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #50CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=C[NH]3)C(O)C1O4886.3Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #51CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)C(O)C1O4901.6Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #52CC(C)(C)[Si](C)(C)OC1C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(OC2=CC=CC3=C2C(CC#N)=CN3[Si](C)(C)C(C)(C)C)C(O)C1O4910.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #53CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4888.1Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #54CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O4906.5Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #55CC(C)(C)[Si](C)(C)OC1C(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C4921.4Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #56CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C4910.0Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=CN4[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O4936.2Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4889.6Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4861.8Semi standard non polar33892256
Cappariloside B,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OCC1OC(OCC2OC(OC3=CC=CC4=C3C(CC#N)=C[NH]4)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4868.1Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Cappariloside B GC-MS (Non-derivatized) - 70eV, Positivesplash10-004i-3752900000-bc16baded44364064e442017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Cappariloside B GC-MS (2 TMS) - 70eV, Positivesplash10-0100-3542219000-05e9840c13680ec5264d2017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Cappariloside B GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 10V, Positive-QTOFsplash10-05i0-0901600000-a9215f402b0b0ea7017a2016-06-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 20V, Positive-QTOFsplash10-0ab9-0901000000-80b0d91ab79f9e3deaea2016-06-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 40V, Positive-QTOFsplash10-0ab9-0900000000-e577dd74b531d3e9ffb62016-06-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 10V, Negative-QTOFsplash10-0092-1912600000-8d6a1a119c8d83cc8d2c2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 20V, Negative-QTOFsplash10-00di-1900100000-6a251b4011f5fb32c8922016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 40V, Negative-QTOFsplash10-00di-2900000000-95d29caa6592f715abbe2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 10V, Positive-QTOFsplash10-006t-0901500000-1adf98833594b0d4c62b2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 20V, Positive-QTOFsplash10-0002-0913400000-7f027b55c8491092899c2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 40V, Positive-QTOFsplash10-007k-1910000000-be2d5506577ecc96738c2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 10V, Negative-QTOFsplash10-0002-0201900000-f80f7d028c60a52d62c92021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 20V, Negative-QTOFsplash10-0a7i-4928800000-ccdb6ca6594ee2d9064b2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Cappariloside B 40V, Negative-QTOFsplash10-0006-2900000000-9781f64bc155fb840e8e2021-09-23Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
Biospecimen LocationsNot Available
Tissue LocationsNot Available
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 IDFDB013530
KNApSAcK IDC00026884
Chemspider IDNot Available
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound73157716
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1846501
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .