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1-(9Z-octadecenoyl)-2-(8Z,11Z,14Z,17Z-eicosatetraenoyl)-3-(11Z-octadecenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM136147 Image of MNXM136147
referenceslm:000190442
formulaC59H102O6
global charge0
mol weight907.459
InChIKeyDQAAATFSRWUDDO-LSMYAOHTSA-N
InChIInChI=1S/C59H102O6/c1-4-7-10-13-16-19-22-25-28-29-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-30-26-23-20-17-14-11-8-5-2)55-64-58(61)52-49-46-43-40-37-34-31-27-24-21-18-15-12-9-6-3/h7,10,16,19-20,23,25,27-28,31-32,35,56H,4-6,8-9,11-15,17-18,21-22,24,26,29-30,33-34,36-55H2,1-3H3/b10-7-,19-16-,23-20-,28-25-,31-27-,35-32-/t56-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCC/C=C\CCCCCC
MNX internals
InChI (mnx)InChI=1/C59H102O6/c1-4-7-10-13-16-19-22-25-28-29-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-30-26-23-20-17-14-11-8-5-2)55-64-58(61)52-49-46-43-40-37-34-31-27-24-21-18-15-12-9-6-3/h7,10,16,19-20,23,25,27-28,31-32,35,56H,4-6,8-9,11-15,17-18,21-22,24,26,29-30,33-34,36-55H2,1-3H3/b10-7-,19-16-,23-20-,28-25-,31-27-,35-32-/t56-/m0/s1 Image of MNXM136147
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:29]/[CH:32]=[CH:35]\[CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][C:59](=[O:62])[O:65][C@@H:56]([CH2:54][O:63][C:57]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:26]/[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:31]=[CH:27]\[CH2:24][CH2:21][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:000190442
slm:000190442
DQAAATFSRWUDDO-LSMYAOHTSA-N
1-(9Z-octadecenoyl)-2-(8Z,11Z,14Z,17Z-eicosatetraenoyl)-3-(11Z-octadecenoyl)-sn-glycerol
TG(18:1(9Z)/20:4(8Z,11Z,14Z,17Z)/18:1(11Z))
Triacylglycerol (18:1(9Z)/20:4(8Z,11Z,14Z,17Z)/18:1(11Z))
hmdb:HMDB0049598
DQAAATFSRWUDDO-LSMYAOHTSA-N
TG(18:1(11Z)/20:4(8Z,11Z,14Z,17Z)/18:1(9Z))
(2S)-1-[(11Z)-octadec-11-enoyloxy]-3-[(9Z)-octadec-9-enoyloxy]propan-2-yl (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate
1-(11Z-Octadecenoyl)-2-(8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(9Z-octadecenoyl)-glycerol
1-Vaccenoyl-2-eicsoatetraenoyl-3-oleoyl-glycerol
TAG(18:1/20:4/18:1)
TAG(56:6)
TG(18:1/20:4/18:1)
TG(56:6)
Tracylglycerol(18:1/20:4/18:1)
Tracylglycerol(56:6)
Triacylglycerol
Triglyceride

hmdb:HMDB49598
secondary/obsolete/fantasy identifier