CHEBI:37386 - aurantio-obtusin

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ChEBI Name aurantio-obtusin
ChEBI ID CHEBI:37386
Definition A trihydroxyanthraquinone that is 1,3,7-trihydroxy-9,10-anthraquinone which is by methoxy groups at positions 2 and 8, and by a methyl group at position 6.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C17H14O7
Net Charge 0
Average Mass 330.28890
Monoisotopic Mass 330.07395
InChI InChI=1S/C17H14O7/c1-6-4-7-11(17(24-3)12(6)19)14(21)10-8(13(7)20)5-9(18)16(23-2)15(10)22/h4-5,18-19,22H,1-3H3
InChIKey RNXZPKOEJUFJON-UHFFFAOYSA-N
SMILES COc1c(O)cc2C(=O)c3cc(C)c(O)c(OC)c3C(=O)c2c1O
ChEBI Ontology
Outgoing aurantio-obtusin (CHEBI:37386) is a trihydroxyanthraquinone (CHEBI:37488)
Incoming aurantio-obtusin β-D-glucoside (CHEBI:28268) has functional parent aurantio-obtusin (CHEBI:37386)
IUPAC Name
1,3,7-trihydroxy-2,8-dimethoxy-6-methylanthracene-9,10-dione
Manual Xref Database
C17670 KEGG COMPOUND
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Registry Number Type Source
67979-25-3 CAS Registry Number ChemIDplus
Last Modified
14 June 2016