Summary

IMPPAT Phytochemical identifier: IMPHY004554

Phytochemical name: Tetradec-13-enal

Synonymous chemical names:
13-tetradecenal

External chemical identifiers:
CID:522841, FDASRS:S6Y6Z62D2O, SureChEMBL:SCHEMBL7522844

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Chemical structure information

SMILES:
C=CCCCCCCCCCCCC=O

InChI:
InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2,14H,1,3-13H2

InChIKey:
ZVJRAGVPKPPDKE-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCCCCCCCC=O

Functional groups:
C=CC, CC=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 aldehydes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty aldehydes

NP-Likeness score: 1.053

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Chemical structure download