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Glu-Glu-Thr

PropertiesImage
MNX_IDMNXM1125485 Image of MNXM1125485
referencechebi:162897
formulaC14H23N3O9
global charge0
mol weight377.35
InChIKeyPHONAZGUEGIOEM-GLLZPBPUSA-N
InChIInChI=1S/C14H23N3O9/c1-6(18)11(14(25)26)17-13(24)8(3-5-10(21)22)16-12(23)7(15)2-4-9(19)20/h6-8,11,18H,2-5,15H2,1H3,(H,16,23)(H,17,24)(H,19,20)(H,21,22)(H,25,26)/t6-,7+,8+,11+/m1/s1
SMILESC[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C14H23N3O9/c1-6(18)11(14(25)26)17-13(24)8(3-5-10(21)22)16-12(23)7(15)2-4-9(19)20/h6-8,11,18H,2-5,15H2,1H3,(H,16,23)(H,17,24)(H,19,20)(H,21,22)(H,25,26)/t6-,7+,8+,11+/m1/s1 Image of MNXM1125485
SMILES (mnx)[CH3:1][C@H:6]([C@@H:11]([C:14](=[O:25])[OH:26])[N:17]=[C:13]([C@H:8]([CH2:3][CH2:5][C:10](=[O:21])[OH:22])[N:16]=[C:12]([C@H:7]([CH2:2][CH2:4][C:9](=[O:19])[OH:20])[NH2:15])[OH:23])[OH:24])[OH:18]
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:162897
chebi:162897
PHONAZGUEGIOEM-GLLZPBPUSA-N
Glu-Glu-Thr
(4S)-4-amino-5-[[(2S)-4-carboxy-1-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-1-oxobutan-2-yl]amino]-5-oxopentanoic acid