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

PropertiesImage
MNX_IDMNXM215417 Image of MNXM215417
referenceslm:000128548
formulaC47H90O6
global charge0
mol weight751.231
InChIKeyDFBSCOYRCSFWIE-SJARJILFSA-N
InChIInChI=1S/C47H90O6/c1-5-7-9-11-13-15-17-19-23-28-32-36-40-47(50)53-44(41-51-45(48)38-34-30-26-22-18-16-14-12-10-8-6-2)42-52-46(49)39-35-31-27-24-20-21-25-29-33-37-43(3)4/h43-44H,5-42H2,1-4H3/t44-/m0/s1
SMILESCCCCCCCCCCCCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C47H90O6/c1-5-7-9-11-13-15-17-19-23-28-32-36-40-47(50)53-44(41-51-45(48)38-34-30-26-22-18-16-14-12-10-8-6-2)42-52-46(49)39-35-31-27-24-20-21-25-29-33-37-43(3)4/h43-44H,5-42H2,1-4H3/t44-/m0/s1 Image of MNXM215417
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:23][CH2:28][CH2:32][CH2:36][CH2:40][C:47](=[O:50])[O:53][C@@H:44]([CH2:41][O:51][C:45]([CH2:38][CH2:34][CH2:30][CH2:26][CH2:22][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:48])[CH2:42][O:52][C:46]([CH2:39][CH2:35][CH2:31][CH2:27][CH2:24][CH2:20][CH2:21][CH2:25][CH2:29][CH2:33][CH2:37][CH:43]([CH3:3])[CH3:4])=[O:49]
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:000128548
slm:000128548
DFBSCOYRCSFWIE-SJARJILFSA-N 		1-(13-methyltetradecanoyl)-2-pentadecanoyl-3-tetradecanoyl-sn-glycerol
TG(15:0/15:0/14:0)
Triacylglycerol (15:0/15:0/14:0)
hmdb:HMDB0099752
DFBSCOYRCSFWIE-SJARJILFSA-N 		TG(14:0/15:0/i-15:0)
(2S)-1-[(13-methyltetradecanoyl)oxy]-3-(tetradecanoyloxy)propan-2-yl pentadecanoate
1-myristoyl-2-pentadecanoyl-3-isopentadecanoyl-glycerol
1-tetradecanoyl-2-pentadecanoyl-3-isopentadecanoyl-glycerol
TAG(14:0/15:0/i-15:0)
TAG(44:0)
TG(44:0)
Tracylglycerol(14:0/15:0/i-15:0)
Tracylglycerol(44:0)
Triacylglycerol
Triglyceride

hmdb:HMDB99752 		secondary/obsolete/fantasy identifier