Summary

IMPPAT Phytochemical identifier: IMPHY004030

Phytochemical name: (S)-nonacosan-10-ol

Synonymous chemical names:
10-nonacosanol, ginnol, nonacosan-10-ol

External chemical identifiers:
CID:16057860, ChEBI:32948, ZINC:ZINC000008221071, FDASRS:4O3O05K5Q3

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCC[C@H](CCCCCCCCC)O

InChI:
InChI=1S/C29H60O/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-29(30)27-25-23-21-10-8-6-4-2/h29-30H,3-28H2,1-2H3/t29-/m0/s1

InChIKey:
CPGCVOVWHCWVTP-LJAQVGFWSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCC[C@H]CCCCCCCCC)))))))))O

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: 0.424

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Chemical structure download