Cas no 5874-95-3 (2-Naphthacenecarboxamide,9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-,(4S,4aS,5aR,12aS)-)

2-Naphthacenecarboxamide,9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-,(4S,4aS,5aR,12aS)- structure
5874-95-3 structure
Product Name:2-Naphthacenecarboxamide,9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-,(4S,4aS,5aR,12aS)-
CAS No:5874-95-3
MF:C21H23N3O7
MW:429.423225641251
CID:372932
PubChem ID:54688693
Update Time:2025-04-19

2-Naphthacenecarboxamide,9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-,(4S,4aS,5aR,12aS)- Chemical and Physical Properties

Names and Identifiers

    • 2-Naphthacenecarboxamide,9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-,(4S,4aS,5aR,12aS)-
    • 9-Didemethyl Minocycline Discontinued-- DO NOT SELL
    • 9-Didemethyl Minocycline
    • 9-DIDEMETHYL MINOCYCLINE HYDROCHLORIDE
    • 9-Didemethyl Minocycline Discontinued-- DO NOT SELL
    • (4S,4aS,5aR,12aS)-9-AMino-4-(diMethylaMino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-2-naphthacenecarboxaMide
    • 9-AMino-6-deMethyl-6-deoxytetracycline Hydrochloride
    • 9-Amino-6-demethyl-6-desoxy-tetracyclin
    • 9-Amino-6-desmethyl-6-desoxy-tetracyclin
    • 9-Amino-6-desoxy-tetracyclin
    • 9-AMinosancycline
    • Amicycline
    • DTXSID601024178
    • Amicicline
    • Discontinued-- DO NOT SELL ''
    • Amicyclinum
    • Q27270890
    • 9-Amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-2-naphthacenecarboxamide
    • UNII-8Q77H788JZ
    • (4S,4aS,5aR,12aR)-9-amino-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide
    • Discontinued-- DO NOT SELL
    • D02899
    • NS00011922
    • 5874-95-3
    • AMICYCLINE [USAN]
    • Amicyclin
    • CHEMBL2104756
    • Amicycline (USAN/INN)
    • SCHEMBL194031
    • 8Q77H788JZ
    • 2-NAPHTHACENECARBOXAMIDE, 9-AMINO-4-(DIMETHYLAMINO)-1,4,4A,5,5A,6,11,12A-OCTAHYDRO-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-, (4S-(4.ALPHA.,4A.ALPHA.,5A.ALPHA.,12A.ALPHA.))-
    • 2-Naphthacenecarboxamide, 9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-, (4S-(4alpha,4aalpha,5aalpha,12aalpha))-
    • CHEBI:188587
    • AMICYCLINE [INN]
    • 9-Amino-4beta-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,10-12,12a-tetrahydroxy-1,11-dioxo-2-naphthacencarboxamid
    • Amicycline [USAN:INN]
    • Inchi: 1S/C21H23N3O7/c1-24(2)14-9-6-8-5-7-3-4-10(22)15(25)11(7)16(26)12(8)18(28)21(9,31)19(29)13(17(14)27)20(23)30/h3-4,8-9,14,25-26,29,31H,5-6,22H2,1-2H3,(H2,23,30)/t8-,9-,14-,21-/m0/s1
    • InChI Key: ZZLPMVKBERHMQN-CROFIWJMSA-N
    • SMILES: O[C@@]12C(=C(C(N)=O)C([C@H]([C@@H]1C[C@@H]1CC3C=CC(=C(C=3C(=C1C2=O)O)O)N)N(C)C)=O)O

Computed Properties

  • Exact Mass: 429.15400
  • Monoisotopic Mass: 429.15360008g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 2
  • Complexity: 926
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.5
  • Topological Polar Surface Area: 187?2

Experimental Properties

  • Melting Point: >185°C (dec.)
  • PSA: 187.41000
  • LogP: 0.98430

2-Naphthacenecarboxamide,9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-,(4S,4aS,5aR,12aS)- Pricemore >>

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2-Naphthacenecarboxamide,9-amino-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-,(4S,4aS,5aR,12aS)- Related Literature

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