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

PropertiesImage
MNX_IDMNXM142152 Image of MNXM142152
referenceslm:000204200
formulaC60H110O6
global charge0
mol weight927.534
InChIKeyPYHWTCSQKVRXCI-BPUMPKAGSA-N
InChIInChI=1S/C60H110O6/c1-4-7-10-13-16-19-22-25-27-29-30-32-34-36-39-41-44-47-50-53-59(62)65-56-57(66-60(63)54-51-48-45-42-37-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-38-35-33-31-28-26-23-20-17-14-11-8-5-2/h17,20,25-28,57H,4-16,18-19,21-24,29-56H2,1-3H3/b20-17-,27-25-,28-26-/t57-/m1/s1
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C60H110O6/c1-4-7-10-13-16-19-22-25-27-29-30-32-34-36-39-41-44-47-50-53-59(62)65-56-57(66-60(63)54-51-48-45-42-37-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-38-35-33-31-28-26-23-20-17-14-11-8-5-2/h17,20,25-28,57H,4-16,18-19,21-24,29-56H2,1-3H3/b20-17-,27-25-,28-26-/t57-/m1/s1 Image of MNXM142152
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22]/[CH:25]=[CH:27]\[CH2:29][CH2:30][CH2:32][CH2:34][CH2:36][CH2:39][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][C:59](=[O:62])[O:65][CH2:56][C@@H:57]([CH2:55][O:64][C:58]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:38][CH2:35][CH2:33][CH2:31]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:61])[O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:37][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:63]
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:000204200
slm:000204200
PYHWTCSQKVRXCI-BPUMPKAGSA-N 		1-(11Z,14Z-eicosadienoyl)-2-pentadecanoyl-3-(13Z-docosenoyl)-sn-glycerol
TG(20:2(11Z,14Z)/15:0/22:1(13Z))
Triacylglycerol (20:2(11Z,14Z)/15:0/22:1(13Z))
hmdb:HMDB0051429
PYHWTCSQKVRXCI-BPUMPKAGSA-N 		TG(22:1(13Z)/15:0/20:2n6)
(2S)-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]-2-(pentadecanoyloxy)propyl (13Z)-docos-13-enoate
1-(13Z-Docosenoyl)-2-pentadecanoyl-3-(11Z,14Z-eicosadienoyl)-glycerol
1-Erucoyl-2-pentadecanoyl-3-eicosadienoyl-glycerol
TAG(22:1/15:0/20:2)
TAG(22:1/15:0/20:2W6)
TAG(22:1/15:0/20:2n6)
TAG(57:3)
TG(22:1(13Z)/15:0/20:2(11Z,14Z))
TG(22:1/15:0/20:2)
TG(22:1/15:0/20:2W6)
TG(22:1/15:0/20:2n6)
TG(22:1W9/15:0/20:2W6)
TG(22:1n9/15:0/20:2n6)
TG(57:3)
Tag(22:1(13Z)/15:0/20:2(11Z,14Z))
Tag(22:1W9/15:0/20:2W6)
Tag(22:1n9/15:0/20:2n6)
Tracylglycerol(22:1/15:0/20:2)
Tracylglycerol(22:1/15:0/20:2W6)
Tracylglycerol(22:1/15:0/20:2n6)
Tracylglycerol(57:3)
Triacylglycerol
Triacylglycerol(22:1(13Z)/15:0/20:2(11Z,14Z))
Triacylglycerol(22:1/15:0/20:2)
Triacylglycerol(22:1W9/15:0/20:2W6)
Triacylglycerol(22:1n9/15:0/20:2n6)
Triacylglycerol(57:3)
Triglyceride

hmdb:HMDB51429 		secondary/obsolete/fantasy identifier