CHEBI:174270 - Coriandrone C

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ChEBI Name Coriandrone C
ChEBI ID CHEBI:174270
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H10O5
Net Charge 0
Average Mass 246.218
Monoisotopic Mass 246.05282
InChI InChI=1S/C13H10O5/c1-16-12-9-2-3-17-10(9)5-7-4-8(6-14)18-13(15)11(7)12/h2-5,14H,6H2,1H3
InChIKey KFOFBVHBCDBMPK-UHFFFAOYSA-N
SMILES O1C2=C(C(OC)=C3C(=C2)C=C(OC3=O)CO)C=C1
ChEBI Ontology
Outgoing Coriandrone C (CHEBI:174270) is a isocoumarins (CHEBI:38758)
IUPAC Name
7-(hydroxymethyl)-4-methoxyuro[2,3-g]isochromen-5-one
Manual Xrefs Databases
30777576 ChemSpider
HMDB0041525 HMDB
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