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1,3-dihexadecanoyl-2-dodecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM178978 Image of MNXM178978
referenceslm:000128614
formulaC47H90O6
global charge0
mol weight751.231
InChIKeyCQLNDFSVEFGNAJ-UHFFFAOYSA-N
InChIInChI=1S/C47H90O6/c1-4-7-10-13-16-19-21-23-25-28-30-33-36-39-45(48)51-42-44(53-47(50)41-38-35-32-27-18-15-12-9-6-3)43-52-46(49)40-37-34-31-29-26-24-22-20-17-14-11-8-5-2/h44H,4-43H2,1-3H3
SMILESCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C47H90O6/c1-4-7-10-13-16-19-21-23-25-28-30-33-36-39-45(48)51-42-44(53-47(50)41-38-35-32-27-18-15-12-9-6-3)43-52-46(49)40-37-34-31-29-26-24-22-20-17-14-11-8-5-2/h44H,4-43H2,1-3H3 Image of MNXM178978
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21][CH2:23][CH2:25][CH2:28][CH2:30][CH2:33][CH2:36][CH2:39][C:45](=[O:48])[O:51][CH2:42][CH:44]([CH2:43][O:52][C:46]([CH2:40][CH2:37][CH2:34][CH2:31][CH2:29][CH2:26][CH2:24][CH2:22][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:49])[O:53][C:47]([CH2:41][CH2:38][CH2:35][CH2:32][CH2:27][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:50]
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:000128614
slm:000128614
CQLNDFSVEFGNAJ-UHFFFAOYSA-N
1,3-dihexadecanoyl-2-dodecanoyl-sn-glycerol
TG(16:0/12:0/16:0)
Triacylglycerol (16:0/12:0/16:0)