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1,2-di-(11-methyldodecanoyl)-3-tetradecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM174475 Image of MNXM174475
referenceslm:000124745
formulaC43H82O6
global charge0
mol weight695.123
InChIKeyJTAKIMZUIJJDOJ-FAIXQHPJSA-N
InChIInChI=1S/C43H82O6/c1-6-7-8-9-10-11-12-13-18-23-28-33-41(44)47-36-40(49-43(46)35-30-25-20-15-17-22-27-32-39(4)5)37-48-42(45)34-29-24-19-14-16-21-26-31-38(2)3/h38-40H,6-37H2,1-5H3/t40-/m0/s1
SMILESCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCC(C)C)OC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C43H82O6/c1-6-7-8-9-10-11-12-13-18-23-28-33-41(44)47-36-40(49-43(46)35-30-25-20-15-17-22-27-32-39(4)5)37-48-42(45)34-29-24-19-14-16-21-26-31-38(2)3/h38-40H,6-37H2,1-5H3/t40-/m0/s1 Image of MNXM174475
SMILES (mnx)[CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:18][CH2:23][CH2:28][CH2:33][C:41](=[O:44])[O:47][CH2:36][C@@H:40]([CH2:37][O:48][C:42]([CH2:34][CH2:29][CH2:24][CH2:19][CH2:14][CH2:16][CH2:21][CH2:26][CH2:31][CH:38]([CH3:2])[CH3:3])=[O:45])[O:49][C:43]([CH2:35][CH2:30][CH2:25][CH2:20][CH2:15][CH2:17][CH2:22][CH2:27][CH2:32][CH:39]([CH3:4])[CH3:5])=[O:46]
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:000124745
slm:000124745
JTAKIMZUIJJDOJ-FAIXQHPJSA-N
1,2-di-(11-methyldodecanoyl)-3-tetradecanoyl-sn-glycerol
TG(13:0/13:0/14:0)
Triacylglycerol (13:0/13:0/14:0)
hmdb:HMDB0099445
JTAKIMZUIJJDOJ-FAIXQHPJSA-N
TG(14:0/i-13:0/i-13:0)
(2S)-2,3-bis[(11-methyldodecanoyl)oxy]propyl tetradecanoate
1-myristoyl-2-isotridecanoyl-3-isotridecanoyl-glycerol
1-tetradecanoyl-2-isotridecanoyl-3-isotridecanoyl-glycerol
TAG(14:0/i-13:0/i-13:0)
TAG(40:0)
TG(40:0)
Tracylglycerol(14:0/i-13:0/i-13:0)
Tracylglycerol(40:0)
Triacylglycerol
Triglyceride

hmdb:HMDB99445
secondary/obsolete/fantasy identifier