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Arginyl-Valyl-Cysteine

PropertiesImage
MNX_IDMNXM744636 Image of MNXM744636
referencebiggM:argvalcys
formulaC14H29N6O4S
global charge1
mol weight377.491
InChIKeyFTMRPIVPSDVGCC-BBBLOLIVSA-O
InChIInChI=1S/C14H28N6O4S/c1-7(2)10(12(22)19-9(6-25)13(23)24)20-11(21)8(15)4-3-5-18-14(16)17/h7-10,25H,3-6,15H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)(H4,16,17,18)/p+1/t8-,9-,10+/m1/s1
SMILESCC(C)[C@H](NC(=O)[C@H](N)CCCNC(N)=[NH2+])C(=O)N[C@H](CS)C(=O)O
MNX internals
InChI (mnx)InChI=1/C14H28N6O4S/c1-7(2)10(12(22)19-9(6-25)13(23)24)20-11(21)8(15)4-3-5-18-14(16)17/h7-10,25H,3-6,15H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)(H4,16,17,18)/t8-,9-,10+/m1/s1 Image of MNXM744636
SMILES (mnx)[CH3:1][CH:7]([CH3:2])[C@@H:10]([C:12](=[N:19][C@H:9]([CH2:6][SH:25])[C:13](=[O:23])[OH:24])[OH:22])[N:20]=[C:11]([C@@H:8]([CH2:4][CH2:3][CH2:5][NH:18][C:14](=[NH:16])[NH2:17])[NH2:15])[OH:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:argvalcys
biggM:argvalcys
vmhM:argvalcys
vmhmetabolite:argvalcys
FTMRPIVPSDVGCC-BBBLOLIVSA-O
Arginyl-Valyl-Cysteine

biggM:M_argvalcys
vmhM:M_argvalcys
secondary/obsolete/fantasy identifier