compound 0072120

Properties Image MNX_ID MNXM1181400 reference envipathM:...7222e594b78e formula C20H36O3 global charge 0 mol weight 324.505 InChIKey XPFGZVHHJVCMLF-UHFFFAOYSA-N InChI InChI=1S/C20H36O3/c1-18(2,23)14-6-7-15-13(11-14)5-8-16-19(15,3)10-9-17(22)20(16,4)12-21/h13-17,21-23H,5-12H2,1-4H3 SMILES CC(C)(O)C1CCC2C(CCC3C(C)(CO)C(O)CCC23C)C1 MNX internals InChI (mnx) InChI=1/C20H36O3/c1-18(2,23)14-6-7-15-13(11-14)5-8-16-19(15,3)10-9-17(22)20(16,4)12-21/h13-17,21-23H,5-12H2,1-4H3/t13?,14?,15?,16?,17?,19?,20? SMILES (mnx) [CH3:1][C:18]([CH3:2])([CH:14]1[CH2:6][CH2:7][CH:15]2[CH:13]([CH2:5][CH2:8][CH:16]3[C:19]2([CH3:3])[CH2:10][CH2:9][CH:17]([OH:22])[C:20]3([CH3:4])[CH2:12][OH:21])[CH2:11]1)[OH:23]

Parent-child relations graph

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