Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID004902

Phytochemical name: Glyceryl palmitate

Synonymous chemical names:
palmitic acid-α-monoglyceride, glycerol monopalmitate, Monopalmitin, monopalmitin, palmitic acid alpha-monoglyceride

External chemical identifiers:
CID:CID_14900, ChEMBL:CHEMBL1078140, ChEBI:CHEBI:75811, FDASRS:U9H9OM3S75, SureChEMBL:SCHEMBL74863, MolPort-001-785-559

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCC(=O)OCC(CO)O

InChI:
InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3

InChIKey:
QHZLMUACJMDIAE-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCC=O)OCCCO))O

Functional groups:
COC(C)=O, CO

Link to spectral information:
MSBNK-Antwerp_Univ-METOX_N106319_9EE2

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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: 0.706

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Chemical structure download