Summary

IMPPAT Phytochemical identifier: IMPHY000557

Phytochemical name: Trilaurin

Synonymous chemical names:
trilaurin

External chemical identifiers:
CID:10851, ChEBI:77389, ZINC:ZINC000032839170, FDASRS:7FP2Z3RVUV, SureChEMBL:SCHEMBL74325, MolPort-003-913-784

---

Chemical structure information

SMILES:
CCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC

InChI:
InChI=1S/C39H74O6/c1-4-7-10-13-16-19-22-25-28-31-37(40)43-34-36(45-39(42)33-30-27-24-21-18-15-12-9-6-3)35-44-38(41)32-29-26-23-20-17-14-11-8-5-2/h36H,4-35H2,1-3H3

InChIKey:
VMPHSYLJUKZBJJ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCC=O)OCCOC=O)CCCCCCCCCCC))))))))))))))COC=O)CCCCCCCCCCC

Functional groups:
COC(C)=O

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Glycerolipids

ClassyFire Subclass: Triradylcglycerols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Glycerolipids

NP Classifier Class: Triacylglycerols

NP-Likeness score: 0.294

---

Chemical structure download