Summary

IMPPAT Phytochemical identifier: IMPHY010196

Phytochemical name: (2E,4E)-2,4-Decadienoic acid

Synonymous chemical names:
decadienoic acid

External chemical identifiers:
CID:5282782, ChEBI:72614, ZINC:ZINC000005820000, SureChEMBL:SCHEMBL258255, MolPort-006-126-056

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Chemical structure information

SMILES:
CCCCC/C=C/C=C/C(=O)O

InChI:
InChI=1S/C10H16O2/c1-2-3-4-5-6-7-8-9-10(11)12/h6-9H,2-5H2,1H3,(H,11,12)/b7-6+,9-8+

InChIKey:
YKHVVNDSWHSBPA-BLHCBFLLSA-N

DeepSMILES:
CCCCC/C=C/C=C/C=O)O

Functional groups:
C/C=C/C=C/C(=O)O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty acids and conjugates

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP Classifier Class: Unsaturated fatty acids

NP-Likeness score: 2.024

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Chemical structure download