Glycyrdione B (CHEBI:197055)

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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	Glycyrdione B

ChEBI ID	CHEBI:197055

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C25H26O5

Net Charge

Average Mass

406.478

Monoisotopic Mass

406.17802

InChI

InChI=1S/C25H26O5/c1-15(2)5-6-17-12-19(23(29)14-21(17)27)22(28)13-20(26)16-7-8-24-18(11-16)9-10-25(3,4)30-24/h5,7-12,14,27,29H,6,13H2,1-4H3

InChIKey

XTBSNHSJEVANCR-UHFFFAOYSA-N

SMILES

O1C(C=CC2=C1C=CC(=C2)C(=O)CC(=O)C=3C=C(CC=C(C)C)C(O)=CC3O)(C)C

Metabolite of Species	Details
Cannabis sativa (NCBI:txid3483)	Found in inflorescence (BTO:0000628). of strain Cannabis sativa var. DMG265 See: MetaboLights Study

ChEBI Ontology
Outgoing	Glycyrdione B (CHEBI:197055) is a dihydrochalcones (CHEBI:71230)

IUPAC Name

1-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-3-(2,2-dimethylchromen-6-yl)propane-1,3-dione