Deoxycommendamide (putative) or in source fragment-H2O observed in AGP sample

Properties Image MNX_ID MNXM1373298 reference chebi:181215 formula C18H33NO3 global charge 0 mol weight 311.466 InChIKey XPLOWAHHERZGRC-CCEZHUSRSA-N InChI InChI=1S/C18H33NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(21)22/h14-15H,2-13,16H2,1H3,(H,19,20)(H,21,22)/b15-14+ SMILES CCCCCCCCCCCCC/C=C/C(=O)NCC(=O)O MNX internals InChI (mnx) InChI=1/C18H33NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(21)22/h14-15H,2-13,16H2,1H3,(H,19,20)(H,21,22)/b15-14+ SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]/[CH:14]=[CH:15]/[C:17](=[N:19]/[CH2:16][C:18](=[O:21])[OH:22])[OH:20]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0