Methyl 1,8,14a-trihydroxy-11-[(4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl)amino]-6a-methoxy-3-methyl-7,9,12,14-tetraoxo-5,6-dihydrobenzo[a]tetracene-2-carboxylate

Base Information

• Chemical Name: Methyl 1,8,14a-trihydroxy-11-[(4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl)amino]-6a-methoxy-3-methyl-7,9,12,14-tetraoxo-5,6-dihydrobenzo[a]tetracene-2-carboxylate
• CAS No.: 115834-25-8
• Molecular Formula: C34H35 N O14
• Molecular Weight: 681.64
• DSSTox Substance ID: DTXSID40921821
• Mol file: 115834-25-8.mol

Synonyms:SF 2446B1;SF2446B1

Chemical Property of Methyl 1,8,14a-trihydroxy-11-[(4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl)amino]-6a-methoxy-3-methyl-7,9,12,14-tetraoxo-5,6-dihydrobenzo[a]tetracene-2-carboxylate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 955.8°Cat760mmHg
• Flash Point: 531.9°C
• Density: 1.56g/cm³
• XLogP3: 2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 7
• Exact Mass: 681.20575479
• Heavy Atom Count: 49
• Complexity: 1430

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• Canonical SMILES: CC1C(C(C(C(O1)NC2=CC(=O)C3=C(C4=C(C=C3C2=O)C(=O)C5(C6=C(CCC5(C4=O)OC)C=C(C(=C6O)C(=O)OC)C)O)O)OC)O)OC

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