Summary

IMPPAT Phytochemical identifier: IMPHY004914

Phytochemical name: Glyceryl monooleate

Synonymous chemical names:
glyceryl monooleate, monoolein

External chemical identifiers:
CID:5283468, ChEMBL:CHEMBL428593, ChEBI:75342, FDASRS:D3AEF6S35P, SureChEMBL:SCHEMBL15603, MolPort-003-849-693

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Chemical structure information

SMILES:
CCCCCCCC/C=CCCCCCCCC(=O)OCC(CO)O

InChI:
InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-

InChIKey:
RZRNAYUHWVFMIP-KTKRTIGZSA-N

DeepSMILES:
CCCCCCCC/C=CCCCCCCCC=O)OCCCO))O

Functional groups:
C/C=CC, CO, COC(C)=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Glycerolipids

ClassyFire Subclass: Monoradylglycerols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Glycerolipids

NP Classifier Class: Monoacylglycerols

NP-Likeness score: 1.068

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Chemical structure download