Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID006045

Phytochemical name: (Z)-Non-2-enal

Synonymous chemical names:
cis-2-nonenal, 2-nonenal,(z), (z)-2-nonenal, nonenal

External chemical identifiers:
CID:CID_5354833, ZINC:ZINC000070450810, FDASRS:ARM1W3309Z, SureChEMBL:SCHEMBL891583

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Chemical structure information

SMILES:
CCCCCC/C=C\C=O

InChI:
InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h7-9H,2-6H2,1H3/b8-7-

InChIKey:
BSAIUMLZVGUGKX-FPLPWBNLSA-N

DeepSMILES:
CCCCCC/C=C\C=O

Functional groups:
C/C=C\C=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbonyl compounds

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty aldehydes

NP-Likeness score: 2.226

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Chemical structure download