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TG(16:1(9Z)/20:0/18:3(9Z,12Z,15Z))

PropertiesImage
MNX_IDMNXM134617 Image of MNXM134617
referencechebi:170927
formulaC57H102O6
global charge0
mol weight883.437
InChIKeyXYIGSYIGMXHUQI-KQCMVNHWSA-N
InChIInChI=1S/C57H102O6/c1-4-7-10-13-16-19-22-25-27-28-30-33-36-39-42-45-48-51-57(60)63-54(52-61-55(58)49-46-43-40-37-34-31-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,54H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-53H2,1-3H3/b11-8-,20-17-,24-21-,29-26-/t54-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C57H102O6/c1-4-7-10-13-16-19-22-25-27-28-30-33-36-39-42-45-48-51-57(60)63-54(52-61-55(58)49-46-43-40-37-34-31-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,54H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-53H2,1-3H3/b11-8-,20-17-,24-21-,29-26-/t54-/m0/s1 Image of MNXM134617
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:28][CH2:30][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][C:57](=[O:60])[O:63][C@@H:54]([CH2:52][O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:58])[CH2:53][O:62][C:56]([CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:59]
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

CHEBI:170927
chebi:170927
XYIGSYIGMXHUQI-KQCMVNHWSA-N
TG(16:1(9Z)/20:0/18:3(9Z,12Z,15Z))
[(2S)-1-[(Z)-hexadec-9-enoyl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropan-2-yl] icosanoate

SLM:000173154
slm:000173154
XYIGSYIGMXHUQI-KQCMVNHWSA-N
1-(9Z,12Z,15Z-octadecatrienoyl)-2-eicosanoyl-3-(9Z-hexadecenoyl)-sn-glycerol
TG(18:3(9Z,12Z,15Z)/20:0/16:1(9Z))
Triacylglycerol (18:3(9Z,12Z,15Z)/20:0/16:1(9Z))
hmdb:HMDB0048516
XYIGSYIGMXHUQI-KQCMVNHWSA-N
TG(16:1(9Z)/20:0/18:3(9Z,12Z,15Z))
(2S)-1-[(9Z)-hexadec-9-enoyloxy]-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propan-2-yl icosanoate
1-(9Z-Hexadecenoyl)-2-eicosanoyl-3-(9Z,12Z,15Z-octadeatrienoyl)-glycerol
1-Palmitoleoyl-2-arachidonyl-3-a-linolenoyl-glycerol
TAG(16:1/20:0/18:3)
TAG(54:4)
TG(16:1/20:0/18:3)
TG(54:4)
Tracylglycerol(16:1/20:0/18:3)
Tracylglycerol(54:4)
Triacylglycerol
Triglyceride

hmdb:HMDB48516
secondary/obsolete/fantasy identifier