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glutathione sulfonate

PropertiesImage
MNX_IDMNXM1113205 Image of MNXM1113205
referencechebi:147425
formulaC10H17N3O9S2
global charge0
mol weight387.392
InChIKeyHBEFTXHFDQJRJD-WDSKDSINSA-N
InChIInChI=1S/C10H17N3O9S2/c11-5(10(18)19)1-2-7(14)13(3-8(15)16)9(17)6(12)4-23-24(20,21)22/h5-6H,1-4,11-12H2,(H,15,16)(H,18,19)(H,20,21,22)/t5-,6-/m0/s1
SMILESN[C@@H](CCC(=O)N(CC(=O)O)C(=O)[C@@H](N)CSS(=O)(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C10H17N3O9S2/c11-5(10(18)19)1-2-7(14)13(3-8(15)16)9(17)6(12)4-23-24(20,21)22/h5-6H,1-4,11-12H2,(H,15,16)(H,18,19)(H,20,21,22)/t5-,6-/m0/s1 Image of MNXM1113205
SMILES (mnx)[CH2:1]([CH2:2][C:7]([N:13]([CH2:3][C:8](=[O:15])[OH:16])[C:9]([C@H:6]([CH2:4][S:23][S:24]([OH:20])(=[O:21])=[O:22])[NH2:12])=[O:17])=[O:14])[C@@H:5]([C:10](=[O:18])[OH:19])[NH2:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:147425
chebi:147425
HBEFTXHFDQJRJD-WDSKDSINSA-N
glutathione sulfonate