CHEBI:225511 - Svalbardine A

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ChEBI Name Svalbardine A
ChEBI ID CHEBI:225511
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H14O6
Net Charge 0
Average Mass 302.282
Monoisotopic Mass 302.07904
InChI InChI=1S/C16H14O6/c1-8-4-12(17)11-7-21-13-6-9(19-2)5-10(16(18)20-3)14(13)15(11)22-8/h4-6H,7H2,1-3H3
InChIKey JVDBGCYLIHXISY-UHFFFAOYSA-N
SMILES O=C1C2=C(OC(=C1)C)C3=C(C=C(OC)C=C3C(=O)OC)OC2
Metabolite of Species Details
Poaceicola (NCBI:txid1821268) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Svalbardine A (CHEBI:225511) is a methoxybenzoic acid (CHEBI:25238)
IUPAC Name
methyl 8-methoxy-2-methyl-4-oxo-5H-pyrano[3,2-c]chromene-10-carboxylate