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1-(6Z,9Z,12Z-octadecatrienoyl)-2-docosanoyl-3-(11Z-eicosenoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM139322 Image of MNXM139322
referenceslm:000235036
formulaC63H114O6
global charge0
mol weight967.599
InChIKeyFRAQRWVCMZTLGK-RGDGXKHXSA-N
InChIInChI=1S/C63H114O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-39-42-45-48-51-54-57-63(66)69-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h18,21,26-27,29,34,40,43,60H,4-17,19-20,22-25,28,30-33,35-39,41-42,44-59H2,1-3H3/b21-18-,29-26-,34-27-,43-40-/t60-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C63H114O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-39-42-45-48-51-54-57-63(66)69-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h18,21,26-27,29,34,40,43,60H,4-17,19-20,22-25,28,30-33,35-39,41-42,44-59H2,1-3H3/b21-18-,29-26-,34-27-,43-40-/t60-/m1/s1 Image of MNXM139322
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:30][CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][C:63](=[O:66])[O:69][C@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46]/[CH:43]=[CH:40]\[CH2:37]/[CH:34]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[CH2:59][O:68][C:62]([CH2:56][CH2:53][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:65]
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:000235036
slm:000235036
FRAQRWVCMZTLGK-RGDGXKHXSA-N 		1-(6Z,9Z,12Z-octadecatrienoyl)-2-docosanoyl-3-(11Z-eicosenoyl)-sn-glycerol
TG(18:3(6Z,9Z,12Z)/22:0/20:1(11Z))
Triacylglycerol (18:3(6Z,9Z,12Z)/22:0/20:1(11Z))
hmdb:HMDB0050400
FRAQRWVCMZTLGK-RGDGXKHXSA-N 		TG(20:1(11Z)/22:0/18:3(6Z,9Z,12Z))
(2S)-1-[(11Z)-icos-11-enoyloxy]-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyloxy]propan-2-yl docosanoate
1-(11-Eicosenoyl)-2-docosanoyl-3-(6Z,9Z,12Z-octadecatrienoyl)-glycerol
1-Eicosenoyl-2-behenoyl-3-g-linolenoyl-glycerol
TAG(20:1/22:0/18:3)
TAG(60:4)
TG(20:1/22:0/18:3)
TG(60:4)
Tracylglycerol(20:1/22:0/18:3)
Tracylglycerol(60:4)
Triacylglycerol
Triglyceride

hmdb:HMDB50400 		secondary/obsolete/fantasy identifier