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glutathione amide perthiol

PropertiesImage
MNX_IDMNXM18161 Image of MNXM18161
referencemetacycM:CPD-6403
formulaC10H18N4O5S2
global charge0
mol weight338.411
InChIKeyBGNRTMCCDBRFLL-WDSKDSINSA-N
InChIInChI=1S/C10H18N4O5S2/c11-5(10(18)19)1-2-8(16)14-6(4-21-20)9(17)13-3-7(12)15/h5-6,20H,1-4,11H2,(H2,12,15)(H,13,17)(H,14,16)(H,18,19)/t5-,6-/m0/s1
SMILESNC(=O)CNC(=O)[C@H](CSS)NC(=O)CC[C@H]([NH3+])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C10H18N4O5S2/c11-5(10(18)19)1-2-8(16)14-6(4-21-20)9(17)13-3-7(12)15/h5-6,20H,1-4,11H2,(H2,12,15)(H,13,17)(H,14,16)(H,18,19)/t5-,6-/m0/s1 Image of MNXM18161
SMILES (mnx)[CH2:1]([CH2:2][C:8](=[N:14][C@@H:6]([CH2:4][S:21][SH:20])[C:9](=[N:13][CH2:3][C:7](=[NH:12])[OH:15])[OH:17])[OH:16])[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)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-6403
metacycM:CPD-6403
BGNRTMCCDBRFLL-WDSKDSINSA-N
glutathione amide perthiol
GASSH

seed.compound:cpd24631
seedM:cpd24631
BGNRTMCCDBRFLL-WDSKDSINSA-N
GASSH
glutathione amide perthiol

seedM:M_cpd24631
secondary/obsolete/fantasy identifier