Difurebin B (CHEBI:208639)

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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	Difurebin B

ChEBI ID	CHEBI:208639

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

Submitter	MetaboLights

Supplier Information

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Formula

C18H20O6

Net Charge

Average Mass

332.352

Monoisotopic Mass

332.12599

InChI

InChI=1S/C18H20O6/c1-7-9(3)15(5)13(21)17(23,11(7)19)16(6)10(4)8(2)12(20)18(15,24)14(16)22/h23-24H,1-6H3/t15-,16+,17-,18+

InChIKey

XAUDMBFOZPLRIC-USTZCAOPSA-N

SMILES

O=C1C(=C([C@]2([C@]3(O)C(=O)C(=C([C@]([C@]1(O)C2=O)(C3=O)C)C)C)C)C)C

Metabolite of Species	Details
Mycosphaerella (NCBI:txid41254)	See: PubMed

ChEBI Ontology
Outgoing	Difurebin B (CHEBI:208639) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(1R,2R,6S,7S)-2,7-dihydroxy-1,4,5,6,9,10-hexamethyltricyclo[5.3.1.12,6]dodeca-4,9-diene-3,8,11,12-tetrone