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1-(13Z-docosenoyl)-2-(11Z,14Z-eicosadienoyl)-3-octadecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM135370 Image of MNXM135370
referenceslm:000236394
formulaC63H116O6
global charge0
mol weight969.615
InChIKeyVFMVVXVFRDLZMQ-HHIZIFKISA-N
InChIInChI=1S/C63H116O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h17,20,25-26,28-29,60H,4-16,18-19,21-24,27,30-59H2,1-3H3/b20-17-,28-25-,29-26-/t60-/m0/s1
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C63H116O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h17,20,25-26,28-29,60H,4-16,18-19,21-24,27,30-59H2,1-3H3/b20-17-,28-25-,29-26-/t60-/m0/s1 Image of MNXM135370
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:28]\[CH2:30][CH2:31][CH2:33][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][C:62](=[O:65])[O:68][CH2:59][C@H:60]([CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:64])[O:69][C:63]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:66]
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:000236394
slm:000236394
VFMVVXVFRDLZMQ-HHIZIFKISA-N 		1-(13Z-docosenoyl)-2-(11Z,14Z-eicosadienoyl)-3-octadecanoyl-sn-glycerol
TG(22:1(13Z)/20:2(11Z,14Z)/18:0)
Triacylglycerol (22:1(13Z)/20:2(11Z,14Z)/18:0)
hmdb:HMDB0045137
VFMVVXVFRDLZMQ-HHIZIFKISA-N 		TG(18:0/20:2n6/22:1(13Z))
(2S)-2-[(11Z,14Z)-icosa-11,14-dienoyloxy]-3-(octadecanoyloxy)propyl (13Z)-docos-13-enoate
1-Octadecanoyl-2-(11Z,14Z-eicosadienoyl)-3-(13Z-docosenoyl)-glycerol
1-Stearoyl-2-eicosadienoyl-3-erucoyl-glycerol
TAG(18:0/20:2/22:1)
TAG(18:0/20:2W6/22:1)
TAG(18:0/20:2n6/22:1)
TAG(60:3)
TG(18:0/20:2(11Z,14Z)/22:1(13Z))
TG(18:0/20:2/22:1)
TG(18:0/20:2W6/22:1)
TG(18:0/20:2W6/22:1W9)
TG(18:0/20:2n6/22:1)
TG(18:0/20:2n6/22:1n9)
TG(60:3)
Tag(18:0/20:2(11Z,14Z)/22:1(13Z))
Tag(18:0/20:2W6/22:1W9)
Tag(18:0/20:2n6/22:1n9)
Tracylglycerol(18:0/20:2/22:1)
Tracylglycerol(18:0/20:2W6/22:1)
Tracylglycerol(18:0/20:2n6/22:1)
Tracylglycerol(60:3)
Triacylglycerol
Triacylglycerol(18:0/20:2(11Z,14Z)/22:1(13Z))
Triacylglycerol(18:0/20:2/22:1)
Triacylglycerol(18:0/20:2W6/22:1W9)
Triacylglycerol(18:0/20:2n6/22:1n9)
Triacylglycerol(60:3)
Triglyceride

hmdb:HMDB45137 		secondary/obsolete/fantasy identifier