(1R,2R)-3-oxo-2-pentyl-cyclopentaneoctanoic acid

Properties Image MNX_ID MNXM24128 reference chebi:187928 formula C18H32O3 global charge 0 mol weight 296.451 InChIKey ITXGIRZCCUTEJX-HZPDHXFCSA-N InChI InChI=1S/C18H32O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h15-16H,2-14H2,1H3,(H,20,21)/t15-,16-/m1/s1 SMILES CCCCC[C@H]1C(=O)CC[C@H]1CCCCCCCC(=O)O MNX internals InChI (mnx) InChI=1/C18H32O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h15-16H,2-14H2,1H3,(H,20,21)/t15-,16-/m1/s1 SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:7][CH2:11][C@@H:16]1[C@H:15]([CH2:10][CH2:8][CH2:5][CH2:4][CH2:6][CH2:9][CH2:12][C:18](=[O:20])[OH:21])[CH2:13][CH2:14][C:17]1=[O:19]

Parent-child relations graph

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