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1,3-didodecanoyl-2-tridecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM178782 Image of MNXM178782
referenceslm:000122339
formulaC40H76O6
global charge0
mol weight653.042
InChIKeyKDKPZWCJVSFOKU-UHFFFAOYSA-N
InChIInChI=1S/C40H76O6/c1-4-7-10-13-16-19-22-25-28-31-34-40(43)46-37(35-44-38(41)32-29-26-23-20-17-14-11-8-5-2)36-45-39(42)33-30-27-24-21-18-15-12-9-6-3/h37H,4-36H2,1-3H3
SMILESCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C40H76O6/c1-4-7-10-13-16-19-22-25-28-31-34-40(43)46-37(35-44-38(41)32-29-26-23-20-17-14-11-8-5-2)36-45-39(42)33-30-27-24-21-18-15-12-9-6-3/h37H,4-36H2,1-3H3 Image of MNXM178782
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:31][CH2:34][C:40](=[O:43])[O:46][CH:37]([CH2:35][O:44][C:38]([CH2:32][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:41])[CH2:36][O:45][C:39]([CH2:33][CH2:30][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:42]
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:000122339
slm:000122339
KDKPZWCJVSFOKU-UHFFFAOYSA-N
1,3-didodecanoyl-2-tridecanoyl-sn-glycerol
TG(12:0/13:0/12:0)
Triacylglycerol (12:0/13:0/12:0)