1,5,6,8-Tetrahydroxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid

Base Information

• Chemical Name: 1,5,6,8-Tetrahydroxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid
• CAS No.: 2960-94-3
• Molecular Formula: C16H10 O8
• DSSTox Substance ID: DTXSID00415695
• Wikidata: Q67457937
• Metabolomics Workbench ID: 102322
• ChEMBL ID: CHEMBL5090356
• Mol file: 2960-94-3.mol

Synonyms:2960-94-3;1,5,6,8-TETRAHYDROXY-3-METHYL-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXYLIC ACID;Clavorubin;CHEMBL5090356;SCHEMBL10905880;DTXSID00415695;1,5,6,8-TETRAHYDROXY-3-METHYL-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXYLICACID

Chemical Property of 1,5,6,8-Tetrahydroxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 1
• Exact Mass: 330.03756727
• Heavy Atom Count: 24
• Complexity: 574

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O