Summary

IMPPAT Phytochemical identifier: IMPHY004880

Phytochemical name: 3-Methyltricosane

Synonymous chemical names:
3-methyltricosane

External chemical identifiers:
CID:528561, SureChEMBL:SCHEMBL10579761, MolPort-046-588-212

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCC(CC)C

InChI:
InChI=1S/C24H50/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(3)5-2/h24H,4-23H2,1-3H3

InChIKey:
WCAGWYVPTZQWEN-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCCC))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: 0.464

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Chemical structure download