Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID000699

Phytochemical name: 1-Nonene

Synonymous chemical names:
nonene,1-, 1-nonene, 1-Nonene

External chemical identifiers:
CID:CID_31285, ChEBI:CHEBI:77443, ZINC:ZINC000001699425, FDASRS:YPK83LUD6G, SureChEMBL:SCHEMBL22589, MolPort-001-756-621

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Chemical structure information

SMILES:
CCCCCCCC=C

InChI:
InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h3H,1,4-9H2,2H3

InChIKey:
JRZJOMJEPLMPRA-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCC=C

Functional groups:
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: 1.129

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Chemical structure download