Summary

IMPPAT Phytochemical identifier: IMPHY013837

Phytochemical name: 1-Heneicosanol

Synonymous chemical names:
1-heneicosanol, heneicosanol

External chemical identifiers:
CID:85014, ChEBI:78410, ZINC:ZINC000095731181, FDASRS:15BB7P0F03, SureChEMBL:SCHEMBL103723, MolPort-003-941-571

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCCO

InChI:
InChI=1S/C21H44O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22/h22H,2-21H2,1H3

InChIKey:
FIPPFBHCBUDBRR-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCO

Functional groups:
CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 0.341

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Chemical structure download