DG(19:1(9Z)/20:2(11Z,14Z)/0:0)[iso2]

Properties Image MNX_ID MNXM104460 reference lipidmapsM:LMGL02010534 formula C42H76O5 global charge 0 mol weight 661.065 InChIKey IPJRCWHACXZLJO-RXRQZIBXSA-N InChI InChI=1S/C42H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-40(38-43)39-46-41(44)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19-20,22,40,43H,3-10,12,14-16,18,21,23-39H2,1-2H3/b13-11-,19-17-,22-20-/t40-/m0/s1 SMILES CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCC/C=C\CCCCCCCCC MNX internals InChI (mnx) InChI=1/C42H76O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-40(38-43)39-46-41(44)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19-20,22,40,43H,3-10,12,14-16,18,21,23-39H2,1-2H3/b13-11-,19-17-,22-20-/t40-/m0/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][C:42](=[O:45])[O:47][C@@H:40]([CH2:38][OH:43])[CH2:39][O:46][C:41]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24]/[CH:22]=[CH:20]\[CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:44]

Parent-child relations graph

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