1,2-dioctanoyl-1,2,3-butanetriol

Properties Image MNX_ID MNXM32165 reference metacycM:CPD0-1762 formula C20H38O5 global charge 0 mol weight 358.519 InChIKey XZRNOEJHMMUVPM-UHFFFAOYSA-N InChI InChI=1S/C20H38O5/c1-4-6-8-10-12-14-19(22)24-16-18(17(3)21)25-20(23)15-13-11-9-7-5-2/h17-18,21H,4-16H2,1-3H3 SMILES CCCCCCCC(=O)OCC(OC(=O)CCCCCCC)C(C)O MNX internals InChI (mnx) InChI=1/C20H38O5/c1-4-6-8-10-12-14-19(22)24-16-18(17(3)21)25-20(23)15-13-11-9-7-5-2/h17-18,21H,4-16H2,1-3H3/t17?,18? SMILES (mnx) [CH3:1][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][C:19](=[O:22])[O:24][CH2:16][CH:18]([CH:17]([CH3:3])[OH:21])[O:25][C:20]([CH2:15][CH2:13][CH2:11][CH2:9][CH2:7][CH2:5][CH3:2])=[O:23]

Parent-child relations graph

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