Sarothranol (CHEBI:187647)

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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	Sarothranol

ChEBI ID	CHEBI:187647

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H18O7

Net Charge

Average Mass

382.368

Monoisotopic Mass

382.10525

InChI

InChI=1S/C21H18O7/c1-21(2)7-6-11-14(28-21)9-15-16(17(11)24)18(25)20(26-3)19(27-15)10-4-5-12(22)13(23)8-10/h4-9,22-24H,1-3H3

InChIKey

PKBDGQRRPFRWSU-UHFFFAOYSA-N

SMILES

O1C(C=CC2=C1C=C3OC(=C(OC)C(=O)C3=C2O)C4=CC(O)=C(O)C=C4)(C)C

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	Sarothranol (CHEBI:187647) is a extended flavonoid (CHEBI:71037)

IUPAC Name

8-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-2,2-dimethylpyrano[3,2-g]chromen-6-one