Summary

IMPPAT Phytochemical identifier: IMPHY016114

Phytochemical name: 9Z-Pentacosene

Synonymous chemical names:
(z)-9-pentacosene

External chemical identifiers:
CID:14159395, FDASRS:IF7R5C51EW, SureChEMBL:SCHEMBL4195698, MolPort-046-683-812

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCC/C=CCCCCCCCC

InChI:
InChI=1S/C25H50/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h17,19H,3-16,18,20-25H2,1-2H3/b19-17-

InChIKey:
YJTCMKZGFBOKQS-ZPHPHTNESA-N

DeepSMILES:
CCCCCCCCCCCCCCC/C=CCCCCCCCC

Functional groups:
C/C=CC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Unsaturated aliphatic hydrocarbons

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.516

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Chemical structure download