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TG(16:1(9Z)/18:2(9Z,12Z)/16:1(9Z))

MNXM178647 is deprecated and replaced by MNXM134527
PropertiesImage
MNX_IDMNXM134527 Image of MNXM134527
referencechebi:171372
formulaC53H94O6
global charge0
mol weight827.329
InChIKeyPDBJSNHIVXKEOI-BGWVPBAESA-N
InChIInChI=1S/C53H94O6/c1-4-7-10-13-16-19-22-25-26-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2)49-58-52(55)46-43-40-37-34-31-28-24-21-18-15-12-9-6-3/h16,19-21,23-26,50H,4-15,17-18,22,27-49H2,1-3H3/b19-16-,23-20-,24-21-,26-25-
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(COC(=O)CCCCCCC/C=C\CCCCCC)COC(=O)CCCCCCC/C=C\CCCCCC
MNX internals
InChI (mnx)InChI=1/C53H94O6/c1-4-7-10-13-16-19-22-25-26-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2)49-58-52(55)46-43-40-37-34-31-28-24-21-18-15-12-9-6-3/h16,19-21,23-26,50H,4-15,17-18,22,27-49H2,1-3H3/b19-16-,23-20-,24-21-,26-25- Image of MNXM134527
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:26]\[CH2:29][CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][C:53](=[O:56])[O:59][CH:50]([CH2:48][O:57][C:51]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:33][CH2:30][CH2:27]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:54])[CH2:49][O:58][C:52]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:28]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:55]
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:171372
chebi:171372
PDBJSNHIVXKEOI-BGWVPBAESA-N 		TG(16:1(9Z)/18:2(9Z,12Z)/16:1(9Z))
1,3-bis[[(Z)-hexadec-9-enoyl]oxy]propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate

SLM:000144341
slm:000144341
PDBJSNHIVXKEOI-BGWVPBAESA-N 		1,3-di-(9Z-hexadecenoyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycerol
TG(16:1(9Z)/18:2(9Z,12Z)/16:1(9Z))
Triacylglycerol (16:1(9Z)/18:2(9Z,12Z)/16:1(9Z))
hmdb:HMDB0048743
PDBJSNHIVXKEOI-BGWVPBAESA-N 		TG(16:1(9Z)/18:2(9Z,12Z)/16:1(9Z))
1,3-bis[(9Z)-hexadec-9-enoyloxy]propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
1-(9Z-Hexadecenoyl)-2-(9Z,12Z-octadecadienoyl)-3-(9Z-hexadecenoyl)-glycerol
1-Palmitoleoyl-2-linoleoyl-3-palmitoleoyl-glycerol
TAG(16:1/18:2/16:1)
TAG(50:4)
TG(16:1/18:2/16:1)
TG(50:4)
Tracylglycerol(16:1/18:2/16:1)
Tracylglycerol(50:4)
Triacylglycerol
Triglyceride

hmdb:HMDB48743 		secondary/obsolete/fantasy identifier