CHEBI:44492 - (1,8-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)acetic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (1,8-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)acetic acid
ChEBI ID CHEBI:44492
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:44488, CHEBI:33092
Supplier Information
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Formula C16H10O6
Net Charge 0
Average Mass 298.24700
Monoisotopic Mass 298.04774
InChI InChI=1S/C16H10O6/c17-10-3-1-2-8-12(10)16(22)13-9(15(8)21)5-4-7(14(13)20)6-11(18)19/h1-5,17,20H,6H2,(H,18,19)
InChIKey IKFRFGXQHSBCQM-UHFFFAOYSA-N
SMILES OC(=O)Cc1ccc2C(=O)c3cccc(O)c3C(=O)c2c1O
ChEBI Ontology
Outgoing (1,8-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)acetic acid (CHEBI:44492) is a anthraquinone (CHEBI:22580)
IUPAC Name
(1,8-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)acetic acid
Synonyms Sources
(1,8-DIHYDROXY-9,10-DIOXO-9,10-DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID PDBeChem
OXIDIZED ACETYL DITHRANOL PDBeChem
Manual Xrefs Databases
DB02019 DrugBank
DB03037 DrugBank
OAL PDBeChem
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Last Modified
07 January 2009