Search MNXref
 Feedback

1-(9Z-hexadecenoyl)-2-hexadecanoyl-3-(9Z,12Z-hexadecadienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM331491 Image of MNXM331491
referenceslm:000136363
formulaC51H92O6
global charge0
mol weight801.291
InChIKeyQXAZQSUCKQGYHI-NKGDXMLJSA-N
InChIInChI=1S/C51H92O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-49(52)55-46-48(57-51(54)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h10,13,19-20,22-23,48H,4-9,11-12,14-18,21,24-47H2,1-3H3/b13-10-,22-19-,23-20-/t48-/m0/s1
SMILESCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C51H92O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-49(52)55-46-48(57-51(54)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h10,13,19-20,22-23,48H,4-9,11-12,14-18,21,24-47H2,1-3H3/b13-10-,22-19-,23-20-/t48-/m0/s1 Image of MNXM331491
SMILES (mnx)[CH3:1][CH2:4][CH2:7]/[CH:10]=[CH:13]\[CH2:16]/[CH:19]=[CH:22]\[CH2:25][CH2:28][CH2:31][CH2:34][CH2:37][CH2:40][CH2:43][C:49](=[O:52])[O:55][CH2:46][C@@H:48]([CH2:47][O:56][C:50]([CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:29][CH2:26]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:53])[O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:27][CH2:24][CH2:21][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:000136363
slm:000136363
QXAZQSUCKQGYHI-NKGDXMLJSA-N
1-(9Z-hexadecenoyl)-2-hexadecanoyl-3-(9Z,12Z-hexadecadienoyl)-sn-glycerol
TG(16:1(9Z)/16:0/16:2(9Z,12Z))
Triacylglycerol (16:1(9Z)/16:0/16:2(9Z,12Z))