Summary

IMPPAT Phytochemical identifier: IMPHY011252

Phytochemical name: 2,4-Undecadienal

Synonymous chemical names:
2,4-undecadienal, 24-undecadienal, undecadienal

External chemical identifiers:
CID:5367531, ChEBI:169399, ZINC:ZINC000001850709, FDASRS:7L26S7BW06, SureChEMBL:SCHEMBL229841, MolPort-006-126-055

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Chemical structure information

SMILES:
CCCCCC/C=C/C=C/C=O

InChI:
InChI=1S/C11H18O/c1-2-3-4-5-6-7-8-9-10-11-12/h7-11H,2-6H2,1H3/b8-7+,10-9+

InChIKey:
UVIUIIFPIWRILL-XBLVEGMJSA-N

DeepSMILES:
CCCCCC/C=C/C=C/C=O

Functional groups:
C/C=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: 2.223

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Chemical structure download