Summary

IMPPAT Phytochemical identifier: IMPHY016459

Phytochemical name: 5-Methylheptadecane

Synonymous chemical names:
5-methylheptadecane

External chemical identifiers:
CID:185593, SureChEMBL:SCHEMBL1646025

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Chemical structure information

SMILES:
CCCCCCCCCCCCC(CCCC)C

InChI:
InChI=1S/C18H38/c1-4-6-8-9-10-11-12-13-14-15-17-18(3)16-7-5-2/h18H,4-17H2,1-3H3

InChIKey:
WHUUMUMJALVXPL-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCC))))C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Saturated hydrocarbons

ClassyFire Subclass: Alkanes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.571

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Chemical structure download