Summary
IMPPAT Phytochemical identifier: IMPHY000031
Phytochemical name: Trimyristin
Synonymous chemical names:glyceryl trimyristate, myristin, trimyristin, trymyristin
External chemical identifiers:CID:11148, ChEBI:77391, ZINC:ZINC000085591205, FDASRS:18L31PSR28, SureChEMBL:SCHEMBL112641, MolPort-001-779-776
Chemical structure information
SMILES:
CCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCInChI:
InChI=1S/C45H86O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-43(46)49-40-42(51-45(48)39-36-33-30-27-24-21-18-15-12-9-6-3)41-50-44(47)38-35-32-29-26-23-20-17-14-11-8-5-2/h42H,4-41H2,1-3H3InChIKey:
DUXYWXYOBMKGIN-UHFFFAOYSA-NDeepSMILES:
CCCCCCCCCCCCCC=O)OCCOC=O)CCCCCCCCCCCCC))))))))))))))))COC=O)CCCCCCCCCCCCCFunctional groups:
COC(C)=O
Chemical classification
ClassyFire Kingdom: Organic compoundsClassyFire Superclass: Lipids and lipid-like moleculesClassyFire Class: Glycerolipids
ClassyFire Subclass: Triradylcglycerols
NP Classifier Biosynthetic pathway: Fatty acids
NP Classifier Superclass: Glycerolipids
NP Classifier Class: Triacylglycerols
NP-Likeness score: 0.26
Chemical structure download
