(E)-Delta-oxomycolate

Properties Image MNX_ID MNXM173972 reference chebi:88037 formula C16H27O4 global charge -1 mol weight 283.388 InChIKey AMYWVAAMWXSUTL-PWUCFTJHSA-M InChI InChI=1S/C16H28O4/c1-5-12(4)14(17)9-7-8-11(3)10-15(18)13(6-2)16(19)20/h7-8,11-13,15,18H,5-6,9-10H2,1-4H3,(H,19,20)/p-1/b8-7+/t11?,12-,13+,15+/m0/s1 SMILES CC[C@H](C)C(=O)C/C=C/C(C)C[C@@H](O)[C@@H](CC)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C16H28O4/c1-5-12(4)14(17)9-7-8-11(3)10-15(18)13(6-2)16(19)20/h7-8,11-13,15,18H,5-6,9-10H2,1-4H3,(H,19,20)/b8-7+/t11?,12-,13+,15+/m0/s1 SMILES (mnx) [CH3:1][CH2:5][C@H:12]([CH3:4])[C:14]([CH2:9]/[CH:7]=[CH:8]/[CH:11]([CH3:3])[CH2:10][C@H:15]([C@@H:13]([CH2:6][CH3:2])[C:16](=[O:19])[OH:20])[OH:18])=[O:17]

Parent-child relations graph

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