Summary

IMPPAT Phytochemical identifier: IMPHY016277

Phytochemical name: 2-Methylpentadecane

Synonymous chemical names:
2-methylpentadecane

External chemical identifiers:
CID:15267, ZINC:ZINC000001701493, FDASRS:04R9AW5KWV, SureChEMBL:SCHEMBL15148

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Chemical structure information

SMILES:
CCCCCCCCCCCCCC(C)C

InChI:
InChI=1S/C16H34/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(2)3/h16H,4-15H2,1-3H3

InChIKey:
BANXPJUEBPWEOT-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCC)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: 0.416

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Chemical structure download