Summary

IMPPAT Phytochemical identifier: IMPHY009156

Phytochemical name: Dodec-11-en-1-al

Synonymous chemical names:
11-dodecenal

External chemical identifiers:
CID:3016614, SureChEMBL:SCHEMBL1701705

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Chemical structure information

SMILES:
C=CCCCCCCCCCC=O

InChI:
InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2,12H,1,3-11H2

InChIKey:
LRLMEXPRIMROMY-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCCCCCC=O

Functional groups:
C=CC, CC=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: 1.215

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Chemical structure download