1,4,6-trihydroxy-8-butyl-9,10-anthraquinone (CHEBI:224024)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:224024 - 1,4,6-trihydroxy-8-butyl-9,10-anthraquinone

Take structure to advanced search

ChEBI ID	CHEBI:224024
ChEBI Name	1,4,6-trihydroxy-8-butyl-9,10-anthraquinone
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H16O5
Net Charge	0
Average Mass	312.321
Monoisotopic Mass	312.09977
SMILES	CCCCc1cc(O)cc2c1C(=O)c1c(O)ccc(O)c1C2=O
InChI	InChI=1S/C18H16O5/c1-2-3-4-9-7-10(19)8-11-14(9)18(23)16-13(21)6-5-12(20)15(16)17(11)22/h5-8,19-21H,2-4H2,1H3
InChIKey	KKPNRHWQCMOTQY-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (24390501)

ChEBI Ontology

Outgoing Relation(s)
	1,4,6-trihydroxy-8-butyl-9,10-anthraquinone (CHEBI:224024) is a hydroxyanthraquinones (CHEBI:37485)

IUPAC Name
1-butyl-3,5,8-trihydroxyanthracene-9,10-dione

Manual Xrefs	Databases
78435679	ChemSpider