CHEBI:174717 - 13alpha-Hydroxydolineone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 13alpha-Hydroxydolineone
ChEBI ID CHEBI:174717
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H12O7
Net Charge 0
Average Mass 352.298
Monoisotopic Mass 352.05830
InChI InChI=1S/C19H12O7/c20-18-10-3-9-1-2-22-12(9)5-13(10)26-17-7-23-14-6-16-15(24-8-25-16)4-11(14)19(17,18)21/h1-6,17,21H,7-8H2
InChIKey HLEAVDSSZUIWQI-UHFFFAOYSA-N
SMILES O1C2C(O)(C=3C(OC2)=CC=4OCOC4C3)C(=O)C5=C1C=C6OC=CC6=C5
ChEBI Ontology
Outgoing 13alpha-Hydroxydolineone (CHEBI:174717) is a rotenones (CHEBI:72581)
IUPAC Name
1-hydroxy-5,7,11,14,18-pentaoxahexacyclo[11.11.0.02,10.04,8.015,23.017,21]tetracosa-2,4(8),9,15(23),16,19,21-heptaen-24-one
Manual Xrefs Databases
24842945 ChemSpider
HMDB0030756 HMDB
LMPK12060033 LIPID MAPS
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