4,6,9-trihydroxy-7-(4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl)oxy-2,8-dimethoxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione

Base Information

• Chemical Name: 4,6,9-trihydroxy-7-(4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl)oxy-2,8-dimethoxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione
• CAS No.: 98813-22-0
• Molecular Formula: C29H34 O12
• Molecular Weight: 574.58
• DSSTox Substance ID: DTXSID50913075
• Wikidata: Q82883598

Synonyms:10-deoxysteffimycin B;steffimycin C

Chemical Property of 4,6,9-trihydroxy-7-(4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl)oxy-2,8-dimethoxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione

Chemical Property:

• Vapor Pressure: 3.19E-24mmHg at 25°C
• Boiling Point: 759.1°Cat760mmHg
• Flash Point: 247.5°C
• PSA: 170.44000
• Density: 1.47g/cm³
• LogP: 1.39730
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 6
• Exact Mass: 574.20502652
• Heavy Atom Count: 41
• Complexity: 977

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(C(C(O1)OC2C(C(CC3=CC4=C(C(=C23)O)C(=O)C5=C(C4=O)C=C(C=C5O)OC)(C)O)OC)OC)O)OC

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