Byrsonic acid

Properties Image MNX_ID MNXM152992 reference chebi:183612 formula C26H48O6 global charge 0 mol weight 456.664 InChIKey ZHSKWVYVCJTAJW-JWQCQUIFSA-N InChI InChI=1S/C26H48O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-24(31-22(2)27)19-17-20-25(21-26(29)30)32-23(3)28/h24-25H,4-21H2,1-3H3,(H,29,30)/t24-,25-/m1/s1 SMILES CCCCCCCCCCCCCCC[C@H](CCC[C@H](CC(=O)O)OC(C)=O)OC(C)=O MNX internals InChI (mnx) InChI=1/C26H48O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-24(31-22(2)27)19-17-20-25(21-26(29)30)32-23(3)28/h24-25H,4-21H2,1-3H3,(H,29,30)/t24-,25-/m1/s1 SMILES (mnx) [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:18][C@H:24]([CH2:19][CH2:17][CH2:20][C@H:25]([CH2:21][C:26](=[O:29])[OH:30])[O:32][C:23]([CH3:3])=[O:28])[O:31][C:22]([CH3:2])=[O:27]

Parent-child relations graph

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