4-dehydroxyaltersolanol A (CHEBI:198822)

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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	4-dehydroxyaltersolanol A

ChEBI ID	CHEBI:198822

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H16O7

Net Charge

Average Mass

320.297

Monoisotopic Mass

320.08960

InChI

InChI=1S/C16H16O7/c1-16(22)5-8-11(14(20)15(16)21)13(19)10-7(12(8)18)3-6(23-2)4-9(10)17/h3-4,14-15,17,20-22H,5H2,1-2H3/t14-,15+,16-/m0/s1

InChIKey

LWVJBIHQFDYBOY-XHSDSOJGSA-N

SMILES

O=C1C2=C(O)C=C(OC)C=C2C(=O)C3=C1[C@H](O)[C@@H](O)[C@](C3)(O)C

Metabolite of Species	Details
Nigrospora oryzae (NCBI:txid335854)	See: PubMed

ChEBI Ontology
Outgoing	4-dehydroxyaltersolanol A (CHEBI:198822) is a hydroxyanthraquinones (CHEBI:37485)

IUPAC Name

(1S,2R,3S)-1,2,3,8-tetrahydroxy-6-methoxy-3-methyl-2,4-dihydro-1H-anthracene-9,10-dione