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1,2,3-tri-(15-methylhexadecanoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM174316 Image of MNXM174316
referenceslm:000153980
formulaC54H104O6
global charge0
mol weight849.42
InChIKeyQYJKRZXJDWTMAR-UHFFFAOYSA-N
InChIInChI=1S/C54H104O6/c1-48(2)40-34-28-22-16-10-7-13-19-25-31-37-43-52(55)58-46-51(60-54(57)45-39-33-27-21-15-9-12-18-24-30-36-42-50(5)6)47-59-53(56)44-38-32-26-20-14-8-11-17-23-29-35-41-49(3)4/h48-51H,7-47H2,1-6H3
SMILESCC(C)CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C54H104O6/c1-48(2)40-34-28-22-16-10-7-13-19-25-31-37-43-52(55)58-46-51(60-54(57)45-39-33-27-21-15-9-12-18-24-30-36-42-50(5)6)47-59-53(56)44-38-32-26-20-14-8-11-17-23-29-35-41-49(3)4/h48-51H,7-47H2,1-6H3 Image of MNXM174316
SMILES (mnx)[CH3:1][CH:48]([CH3:2])[CH2:40][CH2:34][CH2:28][CH2:22][CH2:16][CH2:10][CH2:7][CH2:13][CH2:19][CH2:25][CH2:31][CH2:37][CH2:43][C:52](=[O:55])[O:58][CH2:46][CH:51]([CH2:47][O:59][C:53]([CH2:44][CH2:38][CH2:32][CH2:26][CH2:20][CH2:14][CH2:8][CH2:11][CH2:17][CH2:23][CH2:29][CH2:35][CH2:41][CH:49]([CH3:3])[CH3:4])=[O:56])[O:60][C:54]([CH2:45][CH2:39][CH2:33][CH2:27][CH2:21][CH2:15][CH2:9][CH2:12][CH2:18][CH2:24][CH2:30][CH2:36][CH2:42][CH:50]([CH3:5])[CH3:6])=[O:57]
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:000153980
slm:000153980
QYJKRZXJDWTMAR-UHFFFAOYSA-N
1,2,3-tri-(15-methylhexadecanoyl)-sn-glycerol
TG(17:0/17:0/17:0)
Triacylglycerol (17:0/17:0/17:0)
hmdb:HMDB0106556
QYJKRZXJDWTMAR-UHFFFAOYSA-N
TG(i-17:0/i-17:0/i-17:0)
1,3-Bis[(15-methylhexadecanoyl)oxy]propan-2-yl 15-methylhexadecanoic acid
1,3-bis[(15-methylhexadecanoyl)oxy]propan-2-yl 15-methylhexadecanoate
1-isoheptadecanoyl-2-isoheptadecanoyl-3-isoheptadecanoyl-glycerol
TAG(51:0)
TAG(i-17:0/i-17:0/i-17:0)
TG(51:0)
Tracylglycerol(51:0)
Tracylglycerol(i-17:0/i-17:0/i-17:0)
Triacylglycerol
Triglyceride