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1-(11E-octadecenoyl)-2-(9Z,11E-octadecadienoyl)-3-octacosanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM191538 Image of MNXM191538
referenceslm:000270870
formulaC67H124O6
global charge0
mol weight1025.723
InChIKeyWRMVXEXELSJOHE-SPTRHTEYSA-N
InChIInChI=1S/C67H124O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-40-42-45-48-51-54-57-60-66(69)72-63-64(73-67(70)61-58-55-52-49-46-43-39-27-24-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-41-38-26-23-20-17-14-11-8-5-2/h20-21,23-24,27,39,64H,4-19,22,25-26,28-38,40-63H2,1-3H3/b23-20+,24-21+,39-27-/t64-/m1/s1
SMILESCCCCCC/C=C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C67H124O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-32-33-34-35-36-37-40-42-45-48-51-54-57-60-66(69)72-63-64(73-67(70)61-58-55-52-49-46-43-39-27-24-21-18-15-12-9-6-3)62-71-65(68)59-56-53-50-47-44-41-38-26-23-20-17-14-11-8-5-2/h20-21,23-24,27,39,64H,4-19,22,25-26,28-38,40-63H2,1-3H3/b23-20+,24-21+,39-27-/t64-/m1/s1 Image of MNXM191538
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:40][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:60][C:66](=[O:69])[O:72][CH2:63][C@@H:64]([CH2:62][O:71][C:65]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:26]/[CH:23]=[CH:20]/[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:68])[O:73][C:67]([CH2:61][CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43]/[CH:39]=[CH:27]\[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:70]
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:000270870
slm:000270870
WRMVXEXELSJOHE-SPTRHTEYSA-N
1-(11E-octadecenoyl)-2-(9Z,11E-octadecadienoyl)-3-octacosanoyl-sn-glycerol
TG(18:1(11E)/18:2(9Z,11E)/28:0)
Triacylglycerol (18:1(11E)/18:2(9Z,11E)/28:0)