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1-(11Z-octadecenoyl)-2,3-di-(9Z-octadecenoyl)-sn-glycerol

MNXM135916 is deprecated and here replaced by MNXM728167
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM728167 Image of MNXM728167
referenceslm:000174482
formulaC57H104O6
global charge0
mol weight885.453
InChIKeyJOURDTSYZKYHFB-CNJNCJQRSA-N
InChIInChI=1S/C57H104O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h19,22,26-27,29-30,54H,4-18,20-21,23-25,28,31-53H2,1-3H3/b22-19-,29-26-,30-27-/t54-/m1/s1
SMILESCCCCCC/C=C\CCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C57H104O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h19,22,26-27,29-30,54H,4-18,20-21,23-25,28,31-53H2,1-3H3/b22-19-,29-26-,30-27-/t54-/m1/s1 Image of MNXM728167
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16]/[CH:19]=[CH:22]\[CH2:25][CH2:28][CH2:31][CH2:34][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][C:55](=[O:58])[O:61][CH2:52][C@H:54]([CH2:53][O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32]/[CH:29]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:59])[O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33]/[CH:30]=[CH:27]\[CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:60]
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:000174482
slm:000174482
JOURDTSYZKYHFB-CNJNCJQRSA-N 		1-(11Z-octadecenoyl)-2,3-di-(9Z-octadecenoyl)-sn-glycerol
TG(18:1(11Z)/18:1(9Z)/18:1(9Z))
Triacylglycerol (18:1(11Z)/18:1(9Z)/18:1(9Z))