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1,3-didodecanoyl-2-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM178752 Image of MNXM178752
referenceslm:000125709
formulaC45H78O6
global charge0
mol weight715.113
InChIKeyZXQWHBJKBCBABA-AJXRXSPHSA-N
InChIInChI=1S/C45H78O6/c1-4-7-10-13-16-19-20-21-22-23-24-27-30-33-36-39-45(48)51-42(40-49-43(46)37-34-31-28-25-17-14-11-8-5-2)41-50-44(47)38-35-32-29-26-18-15-12-9-6-3/h7,10,16,19,21-22,24,27,42H,4-6,8-9,11-15,17-18,20,23,25-26,28-41H2,1-3H3/b10-7-,19-16-,22-21-,27-24-
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C45H78O6/c1-4-7-10-13-16-19-20-21-22-23-24-27-30-33-36-39-45(48)51-42(40-49-43(46)37-34-31-28-25-17-14-11-8-5-2)41-50-44(47)38-35-32-29-26-18-15-12-9-6-3/h7,10,16,19,21-22,24,27,42H,4-6,8-9,11-15,17-18,20,23,25-26,28-41H2,1-3H3/b10-7-,19-16-,22-21-,27-24- Image of MNXM178752
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:27]\[CH2:30][CH2:33][CH2:36][CH2:39][C:45](=[O:48])[O:51][CH:42]([CH2:40][O:49][C:43]([CH2:37][CH2:34][CH2:31][CH2:28][CH2:25][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:46])[CH2:41][O:50][C:44]([CH2:38][CH2:35][CH2:32][CH2:29][CH2:26][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:47]
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:000125709
slm:000125709
ZXQWHBJKBCBABA-AJXRXSPHSA-N
1,3-didodecanoyl-2-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycerol
TG(12:0/18:4(6Z,9Z,12Z,15Z)/12:0)
Triacylglycerol (12:0/18:4(6Z,9Z,12Z,15Z)/12:0)