CHEBI:174265 - Glandulone B

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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 Glandulone B
ChEBI ID CHEBI:174265
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H16O3
Net Charge 0
Average Mass 244.290
Monoisotopic Mass 244.10994
InChI InChI=1S/C15H16O3/c1-10(9-16)5-4-6-11(2)13-8-14(17)12(3)7-15(13)18/h5-9H,4H2,1-3H3/b10-5+,11-6+
InChIKey TUGXTSKUBLGSJF-YOYBCKCWSA-N
SMILES O=C1C(/C(=C/C/C=C(\C)/C=O)/C)=CC(=O)C(=C1)C
ChEBI Ontology
Outgoing Glandulone B (CHEBI:174265) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(2E,5E)-2-methyl-6-(4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)hepta-2,5-dienal
Manual Xrefs Databases
30777270 ChemSpider
HMDB0038548 HMDB
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