Hmdb loader
You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on Human Metabolome Database.
Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2013-05-17 00:50:44 UTC
Update Date2021-09-14 15:41:42 UTC
HMDB IDHMDB0060302
Secondary Accession Numbers
  • HMDB60302
Metabolite Identification
Common Name(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene
Description(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene belongs to the class of organic compounds known as naphthalenes. Naphthalenes are compounds containing a naphthalene moiety, which consists of two fused benzene rings (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene is a very strong basic compound (based on its pKa) (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene exists in all living organisms, ranging from bacteria to humans. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
Structure
Data?1563866040
SynonymsNot Available
Chemical FormulaC20H25N3O7S
Average Molecular Weight451.493
Monoisotopic Molecular Weight451.141320859
IUPAC Name(2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-{[(1S,2S)-1-hydroxy-1,2-dihydronaphthalen-2-yl]sulfanyl}ethyl]-C-hydroxycarbonimidoyl}butanoic acid
Traditional Name(2S)-2-amino-4-{[(1R)-1-(carboxymethyl-C-hydroxycarbonimidoyl)-2-{[(1S,2S)-1-hydroxy-1,2-dihydronaphthalen-2-yl]sulfanyl}ethyl]-C-hydroxycarbonimidoyl}butanoic acid
CAS Registry NumberNot Available
SMILES
[H][C@](N)(CCC(O)=N[C@@]([H])(CS[C@@]1([H])C=CC2=CC=CC=C2[C@]1([H])O)C(O)=NCC(O)=O)C(O)=O
InChI Identifier
InChI=1S/C20H25N3O7S/c21-13(20(29)30)6-8-16(24)23-14(19(28)22-9-17(25)26)10-31-15-7-5-11-3-1-2-4-12(11)18(15)27/h1-5,7,13-15,18,27H,6,8-10,21H2,(H,22,28)(H,23,24)(H,25,26)(H,29,30)/t13-,14-,15-,18-/m0/s1
InChI KeyHBBDHJOSZGOTBV-XSWJXKHESA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as naphthalenes. Naphthalenes are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
KingdomOrganic compounds
Super ClassBenzenoids
ClassNaphthalenes
Sub ClassNot Available
Direct ParentNaphthalenes
Alternative Parents
Substituents
  • Naphthalene
  • Oxacycle
  • Organoheterocyclic compound
  • Ether
  • Oxirane
  • Dialkyl ether
  • Organic oxygen compound
  • Hydrocarbon derivative
  • Organooxygen compound
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External Descriptors
Ontology
Disposition

Source

Route of exposure

Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Spectral PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility0.058 g/LALOGPS
logP10(-1.6) g/LALOGPS
logP10(-1.7) g/LChemAxon
logS10(-3.9) g/LALOGPS
pKa (Strongest Acidic)1.96ChemAxon
pKa (Strongest Basic)9.54ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count10ChemAxon
Hydrogen Donor Count6ChemAxon
Polar Surface Area186.03 ŲChemAxon
Rotatable Bond Count11ChemAxon
Refractivity114.1 m³·mol⁻¹ChemAxon
Polarizability45.87 ųChemAxon
Number of Rings2ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Spectral Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+204.03231661259
DarkChem[M-H]-195.70131661259

Predicted Kovats Retention Indices

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TMS,#1C[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O3981.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TMS,#2C[Si](C)(C)O[C@H]1C2=CC=CC=C2C=C[C@@H]1SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O3916.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TMS,#3C[Si](C)(C)OC(=NCC(=O)O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O3956.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TMS,#4C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O3966.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TMS,#5C[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O3918.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TMS,#6C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)C(=O)O4036.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#1C[Si](C)(C)OC(=O)[C@@H](N)CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)O[Si](C)(C)C3813.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#2C[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O3812.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#3C[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C3839.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#4C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C3856.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#5C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)O[Si](C)(C)C)C(=O)O3921.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#6C[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O3761.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#7C[Si](C)(C)OC(=NCC(=O)O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@H](N)C(=O)O3783.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#8C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@H](N)C(=O)O3801.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#9C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O)C(=O)O3880.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#10C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O3816.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#11C[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C3783.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#12C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C)C(=O)O3908.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#13C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O[Si](C)(C)C3821.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#14C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O[Si](C)(C)C)C(=O)O3911.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#15C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)C(=O)O[Si](C)(C)C3887.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TMS,#16C[Si](C)(C)N([C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)C(=O)O)[Si](C)(C)C4074.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#1C[Si](C)(C)OC(=O)[C@@H](N)CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O)O[Si](C)(C)C3685.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#2C[Si](C)(C)OC(=O)[C@@H](N)CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C)O[Si](C)(C)C3707.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#3C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C3746.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#4C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3811.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#5C[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C3696.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#6C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C3714.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#7C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O)O[Si](C)(C)C)C(=O)O3811.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#8C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C3740.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#9C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3821.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#10C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3843.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#11C[Si](C)(C)OC(CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O3926.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#12C[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C3657.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#13C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@H](N)C(=O)O[Si](C)(C)C3686.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#14C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O)C(=O)O[Si](C)(C)C3762.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#15C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@H](N)C(=O)O3675.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#16C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C)C(=O)O3798.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#17C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O[Si](C)(C)C)C(=O)O3791.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#18C[Si](C)(C)O[C@H]1C2=CC=CC=C2C=C[C@@H]1SC[C@H](N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)C(O)=NCC(=O)O3876.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#19C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O[Si](C)(C)C3692.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#20C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3802.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#21C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3787.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#22C[Si](C)(C)OC(=NCC(=O)O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C3904.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#23C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3809.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#24C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C3931.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TMS,#25C[Si](C)(C)OC(=O)[C@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C3930.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#1C[Si](C)(C)OC(=O)[C@@H](N)CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C)O[Si](C)(C)C3597.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#2C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(CC[C@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C3621.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#3C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3703.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#4C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C3623.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#5C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3722.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#6C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3766.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#7C[Si](C)(C)OC(=O)[C@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3863.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#8C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C3613.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#9C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3730.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#10C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3742.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#11C[Si](C)(C)OC(CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O3831.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#12C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3746.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#13C[Si](C)(C)OC(CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C3871.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#14C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C3880.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#15C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@H](N)C(=O)O[Si](C)(C)C3583.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#16C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3685.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#17C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3710.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#18C[Si](C)(C)OC(=O)[C@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O)N([Si](C)(C)C)[Si](C)(C)C3809.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#19C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3708.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#20C[Si](C)(C)OC(=NCC(=O)O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C3812.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#21C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C3808.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#22C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3711.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#23C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C3847.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#24C[Si](C)(C)OC(=O)[C@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3846.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,4TMS,#25C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3876.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#1C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(CC[C@H](N)C(=O)O[Si](C)(C)C)O[Si](C)(C)C3563.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#2C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3660.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#3C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3679.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#4C[Si](C)(C)OC(=O)[C@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(O)=NCC(=O)O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3786.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#5C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3679.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#6C[Si](C)(C)OC(=O)[C@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3841.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#7C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C3853.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#8C[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O3683.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#9C[Si](C)(C)OC(CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C3812.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#10C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C3795.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#11C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C3851.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#12C[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C3647.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#13C[Si](C)(C)OC(=O)[C@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3766.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#14C[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3773.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#15C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C)[Si](C)(C)C3759.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,5TMS,#16C[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@@H](C(=O)O[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C3816.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TBDMS,#1CC(C)(C)[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O4159.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TBDMS,#2CC(C)(C)[Si](C)(C)O[C@H]1C2=CC=CC=C2C=C[C@@H]1SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O4103.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TBDMS,#3CC(C)(C)[Si](C)(C)OC(=NCC(=O)O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O4143.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TBDMS,#4CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O4192.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TBDMS,#5CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O4149.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,1TBDMS,#6CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)C(=O)O4216.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#1CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)O[Si](C)(C)C(C)(C)C4248.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#2CC(C)(C)[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O4211.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#3CC(C)(C)[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C4237.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#5CC(C)(C)[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)O[Si](C)(C)C(C)(C)C)C(=O)O4320.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#6CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O4202.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#7CC(C)(C)[Si](C)(C)OC(=NCC(=O)O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)N=C(O)CC[C@H](N)C(=O)O4186.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#8CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)N=C(O)CC[C@H](N)C(=O)O4241.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#9CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O)C(=O)O4246.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#10CC(C)(C)[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C(C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O4257.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#11CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C4225.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#12CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C)C(=O)O4309.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#13CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C4299.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#14CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O4350.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#15CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C4316.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#16CC(C)(C)[Si](C)(C)N([C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C4462.7Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#1CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O)O[Si](C)(C)C(C)(C)C4321.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#2CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C4331.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#4CC(C)(C)[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C4426.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#5CC(C)(C)[Si](C)(C)OC(CC[C@H](N)C(=O)O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C4307.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#7CC(C)(C)[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O)O[Si](C)(C)C(C)(C)C)C(=O)O4391.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#9CC(C)(C)[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O4429.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#11CC(C)(C)[Si](C)(C)OC(CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O4597.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#12CC(C)(C)[Si](C)(C)OC(=O)[C@@H](N)CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C4285.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#13CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)N=C(O)CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C4362.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#14CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C4383.2Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#15CC(C)(C)[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C(C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)N=C(O)CC[C@H](N)C(=O)O4310.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#16CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C)C(=O)O4367.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#17CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O4405.1Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#18CC(C)(C)[Si](C)(C)O[C@H]1C2=CC=CC=C2C=C[C@@H]1SC[C@H](N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(O)=NCC(=O)O4538.6Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#19CC(C)(C)[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C(C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C4336.5Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#20CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O4428.9Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#21CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(=NCC(=O)O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C4402.4Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#22CC(C)(C)[Si](C)(C)OC(=NCC(=O)O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4585.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#23CC(C)(C)[Si](C)(C)N[C@@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C4454.0Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#24CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(O)CC[C@@H](C(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4623.3Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#25CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(O)=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4601.8Semi standard non polarhttps://arxiv.org/abs/1905.12712
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#4CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C4288.7Semi standard non polarLange, M. and Fedorova, M. (2020) Evaluation of lipid quantification accuracy using HILIC and RPLC MS on the example of NIST SRM 1950 metabolites in human plasma. Anal. Bioanal. Chem. 412(15), 3573-3584.
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#3CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@H](N)C(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C4378.4Semi standard non polarLange, M. and Fedorova, M. (2020) Evaluation of lipid quantification accuracy using HILIC and RPLC MS on the example of NIST SRM 1950 metabolites in human plasma. Anal. Bioanal. Chem. 412(15), 3573-3584.
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#6CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O[Si](C)(C)C(C)(C)C)N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C4351.6Semi standard non polarLange, M. and Fedorova, M. (2020) Evaluation of lipid quantification accuracy using HILIC and RPLC MS on the example of NIST SRM 1950 metabolites in human plasma. Anal. Bioanal. Chem. 412(15), 3573-3584.
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#8CC(C)(C)[Si](C)(C)OC(=O)CN=C(O[Si](C)(C)C(C)(C)C)[C@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C4352.6Semi standard non polarLange, M. and Fedorova, M. (2020) Evaluation of lipid quantification accuracy using HILIC and RPLC MS on the example of NIST SRM 1950 metabolites in human plasma. Anal. Bioanal. Chem. 412(15), 3573-3584.
(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,3TBDMS,#10CC(C)(C)[Si](C)(C)N[C@@H](CCC(=N[C@@H](CS[C@H]1C=CC2=CC=CC=C2[C@@H]1O)C(O)=NCC(=O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C(=O)O4452.8Semi standard non polarLange, M. and Fedorova, M. (2020) Evaluation of lipid quantification accuracy using HILIC and RPLC MS on the example of NIST SRM 1950 metabolites in human plasma. Anal. Bioanal. Chem. 412(15), 3573-3584.
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (Non-derivatized) - 70eV, Positivesplash10-0002-3914600000-b40c96c8e2523516a20e2017-09-20Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (3 TMS) - 70eV, Positivesplash10-0v4i-8692067000-e2127d05e92a6967a0522017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (TBDMS_2_4) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (TBDMS_3_3) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (TBDMS_3_6) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (TBDMS_3_8) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS (TBDMS_3_10) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene GC-MS ("(1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene,2TBDMS,#4" TMS) - 70eV, PositiveNot Available2021-10-14Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene 10V, Positive-QTOFsplash10-00e9-2126900000-1b7006b87834305a79f72015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene 20V, Positive-QTOFsplash10-00di-9226100000-d8fd93086d00e09aaedc2015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene 40V, Positive-QTOFsplash10-00di-9321000000-9198956786ba979c68f92015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene 10V, Negative-QTOFsplash10-0zir-0513900000-b60008cc9c9ba81f90a22015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene 20V, Negative-QTOFsplash10-0a6r-0910000000-16406d930e33b85c278c2015-09-15Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalene 40V, Negative-QTOFsplash10-002f-1900000000-66a973bc3e3243bef84a2015-09-15Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
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 IDNot Available
KNApSAcK IDNot Available
Chemspider ID10128340
KEGG Compound IDC14792
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound11954045
PDB IDNot Available
ChEBI ID34000
Food Biomarker OntologyNot Available
VMH IDM00033
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Magrane M: UniProt Knowledgebase: a hub of integrated protein data. Database (Oxford). 2011 Mar 29;2011:bar009. doi: 10.1093/database/bar009. Print 2011. [PubMed:21447597 ]

Only showing the first 10 proteins. There are 19 proteins in total.

Enzymes

General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTM2
Uniprot ID:
P28161
Molecular weight:
25744.395
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTM1
Uniprot ID:
P09488
Molecular weight:
25711.555
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in protein disulfide oxidoreductase activity
Specific function:
Significant glutathione conjugating activity is found only with the model substrate, 1-chloro-2,4-dinitrobenzene (CDNB).
Gene Name:
GSTK1
Uniprot ID:
Q9Y2Q3
Molecular weight:
31565.605
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in glutathione transferase activity
Specific function:
Also functions as a glutathione peroxidase.
Gene Name:
MGST3
Uniprot ID:
O14880
Molecular weight:
16516.185
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles. May govern uptake and detoxification of both endogenous compounds and xenobiotics at the testis and brain blood barriers.
Gene Name:
GSTM3
Uniprot ID:
P21266
Molecular weight:
26559.32
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTA1
Uniprot ID:
P08263
Molecular weight:
25630.785
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles. Has a wide substrate specificity.
Gene Name:
MGST1
Uniprot ID:
P10620
Molecular weight:
17598.45
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles. Active on 1-chloro-2,4-dinitrobenzene.
Gene Name:
GSTM4
Uniprot ID:
Q03013
Molecular weight:
25561.095
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTM5
Uniprot ID:
P46439
Molecular weight:
25674.455
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails
General function:
Involved in enzyme activator activity
Specific function:
Can catalyze the production of LTC4 from LTA4 and reduced glutathione. Can catalyze the conjugation of 1-chloro-2,4-dinitrobenzene with reduced glutathione.
Gene Name:
MGST2
Uniprot ID:
Q99735
Molecular weight:
16620.4
Reactions
(1S,2R)-Naphthalene 1,2-oxide + Glutathione → (1S)-Hydroxy-(2S)-glutathionyl-1,2-dihydronaphthalenedetails

Only showing the first 10 proteins. There are 19 proteins in total.