Astropaquinone B (CHEBI:212863)

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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	Astropaquinone B

ChEBI ID	CHEBI:212863

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H18O6

Net Charge

Average Mass

318.325

Monoisotopic Mass

318.11034

InChI

InChI=1S/C17H18O6/c1-8-5-10-14(17(22-4)23-8)16(19)13-11(15(10)18)6-9(20-2)7-12(13)21-3/h6-8,17H,5H2,1-4H3/t8-,17+/m0/s1

InChIKey

ZUCKMONTTODKPQ-WNWIJWBNSA-N

SMILES

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

Metabolite of Species	Details
Astrosphaeriella (NCBI:txid682060)	See: PubMed

Roles Classification
Biological Role(s):	antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. (via heterocyclic antibiotic )

ChEBI Ontology
Outgoing	Astropaquinone B (CHEBI:212863) is a benzoisochromanequinone (CHEBI:48129)

IUPAC Name

(1R,3S)-1,7,9-trimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione