Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID003473

Phytochemical name: 2-Methyltetradecane

Synonymous chemical names:
2-methyl-tetradecane, tetradecane,2-methyl, 2-methyltetradecane

External chemical identifiers:
CID:CID_15268, ZINC:ZINC000002563407, FDASRS:6V30XLA02Y, SureChEMBL:SCHEMBL157759

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Chemical structure information

SMILES:
CCCCCCCCCCCCC(C)C

InChI:
InChI=1S/C15H32/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h15H,4-14H2,1-3H3

InChIKey:
KUVMKLCGXIYSNH-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCC)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: 0.444

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Chemical structure download