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TG(22:0/16:0/14:1(9Z))

PropertiesImage
MNX_IDMNXM110932 Image of MNXM110932
referencechebi:171540
formulaC55H104O6
global charge0
mol weight861.431
InChIKeyVJTNIYIXYIDDSH-AYIAWJIRSA-N
InChIInChI=1S/C55H104O6/c1-4-7-10-13-16-19-22-24-25-26-27-28-29-31-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-30-23-20-17-14-11-8-5-2/h15,18,52H,4-14,16-17,19-51H2,1-3H3/b18-15-/t52-/m1/s1
SMILESCCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C55H104O6/c1-4-7-10-13-16-19-22-24-25-26-27-28-29-31-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-30-23-20-17-14-11-8-5-2/h15,18,52H,4-14,16-17,19-51H2,1-3H3/b18-15-/t52-/m1/s1 Image of MNXM110932
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][CH2:48][C:54](=[O:57])[O:60][CH2:51][C@@H:52]([CH2:50][O:59][C:53]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:21]/[CH:18]=[CH:15]\[CH2:12][CH2:9][CH2:6][CH3:3])=[O:56])[O:61][C:55]([CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:30][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:58]
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:171540
chebi:171540
VJTNIYIXYIDDSH-AYIAWJIRSA-N 		TG(22:0/16:0/14:1(9Z))
[(2S)-2-hexadecanoyloxy-3-[(Z)-tetradec-9-enoyl]oxypropyl] docosanoate

SLM:000159480
slm:000159480
VJTNIYIXYIDDSH-AYIAWJIRSA-N 		1-(9Z-tetradecenoyl)-2-hexadecanoyl-3-docosanoyl-sn-glycerol
TG(14:1(9Z)/16:0/22:0)
Triacylglycerol (14:1(9Z)/16:0/22:0)

lipidmaps:LMGL03014646
lipidmapsM:LMGL03014646
VJTNIYIXYIDDSH-AYIAWJIRSA-N 		TG(14:1(9Z)/16:0/22:0)[iso6]
1-(9Z-tetradecenoyl)-2-hexadecanoyl-3-docosanoyl-sn-glycerol
TG 52:1
TG(14:1_16:0_22:0)
TG(52:1)
hmdb:HMDB0046308
VJTNIYIXYIDDSH-AYIAWJIRSA-N 		TG(22:0/16:0/14:1(9Z))
(2S)-2-(hexadecanoyloxy)-3-[(9Z)-tetradec-9-enoyloxy]propyl docosanoate
1-Behenoyl-2-palmitoyl-3-myristoleoyl-glycerol
1-Docosanoyl-2-hexadecanoyl-3-(9Z-tetradecenoyl)-glycerol
TAG(22:0/16:0/14:1)
TAG(52:1)
TG(22:0/16:0/14:1)
TG(52:1)
Tracylglycerol(22:0/16:0/14:1)
Tracylglycerol(52:1)
Triacylglycerol
Triglyceride

hmdb:HMDB46308 		secondary/obsolete/fantasy identifier