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1,3-di-(9Z-hexadecenoyl)-2-(6Z,9Z,12Z,15Z,18Z,21Z-tetracosahexaenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM178639 Image of MNXM178639
referenceslm:000186690
formulaC59H98O6
global charge0
mol weight903.427
InChIKeyOEAQUUKXWWWVHP-GEMDJBRGSA-N
InChIInChI=1S/C59H98O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-23-20-17-14-11-8-5-2)55-64-58(61)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3/h7,10,16,19-21,23-26,28-29,31-32,38,41,56H,4-6,8-9,11-15,17-18,22,27,30,33-37,39-40,42-55H2,1-3H3/b10-7-,19-16-,23-20-,24-21-,26-25-,29-28-,32-31-,41-38-
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC(COC(=O)CCCCCCC/C=C\CCCCCC)COC(=O)CCCCCCC/C=C\CCCCCC
MNX internals
InChI (mnx)InChI=1/C59H98O6/c1-4-7-10-13-16-19-22-25-26-27-28-29-30-31-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-23-20-17-14-11-8-5-2)55-64-58(61)52-49-46-43-40-37-34-24-21-18-15-12-9-6-3/h7,10,16,19-21,23-26,28-29,31-32,38,41,56H,4-6,8-9,11-15,17-18,22,27,30,33-37,39-40,42-55H2,1-3H3/b10-7-,19-16-,23-20-,24-21-,26-25-,29-28-,32-31-,41-38- Image of MNXM178639
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:35]/[CH:38]=[CH:41]\[CH2:44][CH2:47][CH2:50][CH2:53][C:59](=[O:62])[O:65][CH:56]([CH2:54][O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[CH2:55][O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:61]
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:000186690
slm:000186690
OEAQUUKXWWWVHP-GEMDJBRGSA-N
1,3-di-(9Z-hexadecenoyl)-2-(6Z,9Z,12Z,15Z,18Z,21Z-tetracosahexaenoyl)-sn-glycerol
TG(16:1(9Z)/24:6(6Z,9Z,12Z,15Z,18Z,21Z)/16:1(9Z))
Triacylglycerol (16:1(9Z)/24:6(6Z,9Z,12Z,15Z,18Z,21Z)/16:1(9Z))