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1-(11-methyldodecanoyl)-2-(15-methylhexadecanoyl)-3-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM186429 Image of MNXM186429
referenceslm:000136416
formulaC51H92O6
global charge0
mol weight801.291
InChIKeyOXOITVROFKODTK-CDWXORGCSA-N
InChIInChI=1S/C51H92O6/c1-6-7-8-9-10-11-12-13-14-15-18-21-26-31-36-41-49(52)55-44-48(45-56-50(53)42-37-32-28-23-25-30-35-40-47(4)5)57-51(54)43-38-33-27-22-19-16-17-20-24-29-34-39-46(2)3/h7-8,10-11,13-14,46-48H,6,9,12,15-45H2,1-5H3/b8-7-,11-10-,14-13-/t48-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C51H92O6/c1-6-7-8-9-10-11-12-13-14-15-18-21-26-31-36-41-49(52)55-44-48(45-56-50(53)42-37-32-28-23-25-30-35-40-47(4)5)57-51(54)43-38-33-27-22-19-16-17-20-24-29-34-39-46(2)3/h7-8,10-11,13-14,46-48H,6,9,12,15-45H2,1-5H3/b8-7-,11-10-,14-13-/t48-/m0/s1 Image of MNXM186429
SMILES (mnx)[CH3:1][CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15][CH2:18][CH2:21][CH2:26][CH2:31][CH2:36][CH2:41][C:49](=[O:52])[O:55][CH2:44][C@@H:48]([CH2:45][O:56][C:50]([CH2:42][CH2:37][CH2:32][CH2:28][CH2:23][CH2:25][CH2:30][CH2:35][CH2:40][CH:47]([CH3:4])[CH3:5])=[O:53])[O:57][C:51]([CH2:43][CH2:38][CH2:33][CH2:27][CH2:22][CH2:19][CH2:16][CH2:17][CH2:20][CH2:24][CH2:29][CH2:34][CH2:39][CH:46]([CH3:2])[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:000136416
slm:000136416
OXOITVROFKODTK-CDWXORGCSA-N
1-(11-methyldodecanoyl)-2-(15-methylhexadecanoyl)-3-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycerol
TG(13:0/17:0/18:3(9Z,12Z,15Z))
Triacylglycerol (13:0/17:0/18:3(9Z,12Z,15Z))