Desmocarpin (CHEBI:178309)

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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	Desmocarpin

ChEBI ID	CHEBI:178309

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H14O5

Net Charge

Average Mass

286.283

Monoisotopic Mass

286.08412

InChI

InChI=1S/C16H14O5/c1-19-9-5-12(18)15-14(6-9)20-7-11-10-3-2-8(17)4-13(10)21-16(11)15/h2-6,11,16-18H,7H2,1H3

InChIKey

WEVPCLOHVKGGEZ-UHFFFAOYSA-N

SMILES

O1C2C(C3=C1C=C(O)C=C3)COC=4C2=C(O)C=C(OC)C4

ChEBI Ontology
Outgoing	Desmocarpin (CHEBI:178309) is a pterocarpans (CHEBI:26377)

IUPAC Name

3-methoxy-6a,11a-dihydro-6H-[1]benzouro[3,2-c]chromene-1,9-diol