Chem
J-GLOBAL ID：200907063456648217   Nikkaji number：J2.763.320J

4-Dedimethyl-6-dehydro-anhydrotetracycline

4-デジメチル-6-デヒドロ-アンヒドロテトラサイクリン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H18N2O7
Molecular formula furigana： C20-H18-N2-O7
Molecular weight： 398.371
InChI： InChI=1S/C20H18N2O7/c1-6-7-3-2-4-10(23)11(7)15(24)12-8(6)5-9-14(21)16(25)13(19(22)28)18(27)20(9,29)17(12)26/h2-4,9,14,23-25,29H,5,21H2,1H3,(H2,22,28)/t9?,14-,20-/m0/s1
InChI key： INUFQOJZVFLXMQ-RQHCSDSKSA-N
SMILES： Cc1c2CC3[C@H](N)C(=C(C(=O)N)C(=O)[C@@]3(O)C(=O)c2c(O)c2c(O)cccc12)O
Systematic name  (3)：
  • (4S,12aS)-4-アミノ-3,10,11,12a-テトラヒドロキシ-1,4,4a,5,12,12a-ヘキサヒドロ-6-メチル-1,12-ジオキソナフタセン-2-カルボアミド
  • (4S,12aS)-4-アミノ-3,10,11,12a-テトラヒドロキシ-6-メチル-1,12-ジオキソ-1,4,4a,5,12,12a-ヘキサヒドロテトラセン-2-カルボキサミド
  • (4S,12aS)-4-amino-3,10,11,12a-tetrahydroxy-6-methyl-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide
Other name (3)：
  • (4S,12aS)-4-Amino-3,10,11,12a-tetrahydroxy-1,4,4a,5,12,12a-hexahydro-6-methyl-1,12-dioxonaphthacene-2-carboxamide
  • 4-Dedimethyl-6-dehydro-anhydrotetracycline
  • 4-デジメチル-6-デヒドロ-アンヒドロテトラサイクリン
KEGG COMPOUND： C06654
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