Chem
J-GLOBAL ID：200907098520649450   Nikkaji number：J479.691H

Tetracenomycin C

テトラセノマイシンC
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： C23H20O11
Molecular formula furigana： C23-H20-O11
Molecular weight： 472.402
InChI： InChI=1S/C23H20O11/c1-8-14-9(6-11(32-2)15(8)21(29)34-4)5-10-16(17(14)25)20(28)22(30)13(24)7-12(33-3)19(27)23(22,31)18(10)26/h5-7,19,25,27,30-31H,1-4H3/t19-,22-,23-/m1/s1
InChI key： ULHJWHCSSAEMLW-UEVCKROQSA-N
SMILES： COC(=O)c1c(C)c2c(O)c3C(=O)[C@]4(O)C(=O)C=C(OC)[C@@H](O)[C@]4(O)C(=O)c3cc2cc1OC
Systematic name  (3)：
  • (6aR)-6,6a,7,10,10a,11-ヘキサヒドロ-6aα,7α,10aα,12-テトラヒドロキシ-3,8-ジメトキシ-1-メチル-6,10,11-トリオキソ-2-ナフタセンカルボン酸メチル
  • メチル (6aR,7S,10aR)-6a,7,10a,12-テトラヒドロキシ-3,8-ジメトキシ-1-メチル-6,10,11-トリオキソ-6,6a,7,10,10a,11-ヘキサヒドロテトラセン-2-カルボキシラート
  • methyl (6aR,7S,10aR)-6a,7,10a,12-tetrahydroxy-3,8-dimethoxy-1-methyl-6,10,11-trioxo-6,6a,7,10,10a,11-hexahydrotetracene-2-carboxylate
Other name (2)：
  • テトラセノマイシンC
  • Tetracenomycin C
CAS registry number： 71135-22-3
KEGG COMPOUND： C06801
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