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1-(13-methyltetradecanoyl)-2-eicosanoyl-3-tetradecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM214873 Image of MNXM214873
referenceslm:000142454
formulaC52H100O6
global charge0
mol weight821.366
InChIKeyCMUMPVOIJQOMTP-GGCSAXROSA-N
InChIInChI=1S/C52H100O6/c1-5-7-9-11-13-15-17-18-19-20-21-22-24-28-33-37-41-45-52(55)58-49(46-56-50(53)43-39-35-31-27-23-16-14-12-10-8-6-2)47-57-51(54)44-40-36-32-29-25-26-30-34-38-42-48(3)4/h48-49H,5-47H2,1-4H3/t49-/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C52H100O6/c1-5-7-9-11-13-15-17-18-19-20-21-22-24-28-33-37-41-45-52(55)58-49(46-56-50(53)43-39-35-31-27-23-16-14-12-10-8-6-2)47-57-51(54)44-40-36-32-29-25-26-30-34-38-42-48(3)4/h48-49H,5-47H2,1-4H3/t49-/m0/s1 Image of MNXM214873
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:24][CH2:28][CH2:33][CH2:37][CH2:41][CH2:45][C:52](=[O:55])[O:58][C@@H:49]([CH2:46][O:56][C:50]([CH2:43][CH2:39][CH2:35][CH2:31][CH2:27][CH2:23][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:53])[CH2:47][O:57][C:51]([CH2:44][CH2:40][CH2:36][CH2:32][CH2:29][CH2:25][CH2:26][CH2:30][CH2:34][CH2:38][CH2:42][CH:48]([CH3:3])[CH3:4])=[O:54]
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:000142454
slm:000142454
CMUMPVOIJQOMTP-GGCSAXROSA-N 		1-(13-methyltetradecanoyl)-2-eicosanoyl-3-tetradecanoyl-sn-glycerol
TG(15:0/20:0/14:0)
Triacylglycerol (15:0/20:0/14:0)
hmdb:HMDB0100413
CMUMPVOIJQOMTP-GGCSAXROSA-N 		TG(14:0/20:0/i-15:0)
(2S)-1-[(13-methyltetradecanoyl)oxy]-3-(tetradecanoyloxy)propan-2-yl icosanoate
1-myristoyl-2-arachidonyl-3-isopentadecanoyl-glycerol
1-tetradecanoyl-2-eicosanoyl-3-isopentadecanoyl-glycerol
TAG(14:0/20:0/i-15:0)
TAG(49:0)
TG(49:0)
Tracylglycerol(14:0/20:0/i-15:0)
Tracylglycerol(49:0)
Triacylglycerol
Triglyceride