Metesind glucuronate

Base Information

• Chemical Name: Metesind glucuronate
• CAS No.: 157182-23-5
• Molecular Formula: C29H34N4O10S
• Molecular Weight: 630.6661
• UNII: 8EC044476N
• Wikidata: Q27270253
• NCI Thesaurus Code: C175129

Synonyms:AG 331;AG-331;N(6)-(4-(N-morpholinosulfonyl)benzyl)-N(6)-methyl-2,6-diaminobenz(cd)indole glucuronate

Chemical Property of Metesind glucuronate

Chemical Property:

• Boiling Point: 943.7°Cat760mmHg
• Flash Point: 524.6°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 10
• Exact Mass: 630.19956447
• Heavy Atom Count: 44
• Complexity: 960

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CN(CC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)C3=C4C=CC=C5C4=C(C=C3)N=C5N.C(=O)C(C(C(C(C(=O)O)O)O)O)O
• Isomeric SMILES: CN(CC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)C3=C4C=CC=C5C4=C(C=C3)N=C5N.C(=O)[C@@H]([C@H]([C@@H]([C@@H](C(=O)O)O)O)O)O

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