CHEBI:195660 - 3-heptenal

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 3-heptenal
ChEBI ID CHEBI:195660
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C7H12O
Net Charge 0
Average Mass 112.172
Monoisotopic Mass 112.08882
InChI InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h4-5,7H,2-3,6H2,1H3/b5-4+
InChIKey ORAQCSKNITWHDW-SNAWJCMRSA-N
SMILES O=CC\C=C\CCC
ChEBI Ontology
Outgoing 3-heptenal (CHEBI:195660) is a monounsaturated fatty aldehyde (CHEBI:61870)
IUPAC Name
(E)-hept-3-enal
Manual Xrefs Databases
4446438 ChemSpider
LMFA06000020 LIPID MAPS
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Last Modified
07 June 2024