Summary

IMPPAT Phytochemical identifier: IMPHY014087

Phytochemical name: trans-2-Tridecen-1-ol

Synonymous chemical names:
(e)-2-tridecen-1-ol, 2-tridecen-1-ol

External chemical identifiers:
CID:5364949, ChEMBL:CHEMBL2228469, ZINC:ZINC000002560462, FDASRS:VND7X225Z7, SureChEMBL:SCHEMBL1245079

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Chemical structure information

SMILES:
CCCCCCCCCC/C=C/CO

InChI:
InChI=1S/C13H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h11-12,14H,2-10,13H2,1H3/b12-11+

InChIKey:
VPYJHNADOJDSGU-VAWYXSNFSA-N

DeepSMILES:
CCCCCCCCCC/C=C/CO

Functional groups:
C/C=C/C, 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: 1.571

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Chemical structure download