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1-(9Z,12Z-hexadecadienoyl)-2-dodecanoyl-3-(11Z,14Z-eicosadienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM324504 Image of MNXM324504
referenceslm:000135772
formulaC51H90O6
global charge0
mol weight799.275
InChIKeyAKTUHUKLKYXCRY-KGXMHGIJSA-N
InChIInChI=1S/C51H90O6/c1-4-7-10-13-16-19-21-23-24-25-26-28-30-33-35-38-41-44-50(53)56-47-48(57-51(54)45-42-39-36-31-18-15-12-9-6-3)46-55-49(52)43-40-37-34-32-29-27-22-20-17-14-11-8-5-2/h11,14,16,19-20,22-24,48H,4-10,12-13,15,17-18,21,25-47H2,1-3H3/b14-11-,19-16-,22-20-,24-23-/t48-/m1/s1
SMILESCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C51H90O6/c1-4-7-10-13-16-19-21-23-24-25-26-28-30-33-35-38-41-44-50(53)56-47-48(57-51(54)45-42-39-36-31-18-15-12-9-6-3)46-55-49(52)43-40-37-34-32-29-27-22-20-17-14-11-8-5-2/h11,14,16,19-20,22-24,48H,4-10,12-13,15,17-18,21,25-47H2,1-3H3/b14-11-,19-16-,22-20-,24-23-/t48-/m1/s1 Image of MNXM324504
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:28][CH2:30][CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][C:50](=[O:53])[O:56][CH2:47][C@@H:48]([CH2:46][O:55][C:49]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:32][CH2:29][CH2:27]/[CH:22]=[CH:20]\[CH2:17]/[CH:14]=[CH:11]\[CH2:8][CH2:5][CH3:2])=[O:52])[O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:31][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:54]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000135772
slm:000135772
AKTUHUKLKYXCRY-KGXMHGIJSA-N
1-(9Z,12Z-hexadecadienoyl)-2-dodecanoyl-3-(11Z,14Z-eicosadienoyl)-sn-glycerol
TG(16:2(9Z,12Z)/12:0/20:2(11Z,14Z))
Triacylglycerol (16:2(9Z,12Z)/12:0/20:2(11Z,14Z))