Artonol B (CHEBI:172660)

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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	Artonol B

ChEBI ID	CHEBI:172660

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C24H20O7

Net Charge

Average Mass

420.417

Monoisotopic Mass

420.12090

InChI

InChI=1S/C24H20O7/c1-10(25)16-17-13(24(4,5)31-22(17)28)8-12-19(27)18-14(26)9-15-11(20(18)29-21(12)16)6-7-23(2,3)30-15/h6-9,26H,1-5H3

InChIKey

LWJBUOOKYYTUDX-UHFFFAOYSA-N

SMILES

O1C(C2=C(C(=C3OC4=C(C(=O)C3=C2)C(O)=CC=5OC(C=CC45)(C)C)C(=O)C)C1=O)(C)C

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). See: MetaboLights Study

ChEBI Ontology
Outgoing	Artonol B (CHEBI:172660) is a pyranoxanthones (CHEBI:71238)

IUPAC Name

10-acetyl-21-hydroxy-6,6,17,17-tetramethyl-7,12,18-trioxapentacyclo[11.8.0.03,11.05,9.014,19]henicosa-1(13),3,5(9),10,14(19),15,20-heptaene-2,8-dione