Chem
J-GLOBAL ID：200907074676206985   Nikkaji number：J1.275.898G

Tetracenomycin X

テトラセノマイシンX
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： C24H22O11
Molecular formula furigana： C24-H22-O11
Molecular weight： 486.429
InChI： InChI=1S/C24H22O11/c1-9-15-10(7-12(32-2)16(9)22(30)34-4)6-11-17(18(15)26)21(29)24(35-5)14(25)8-13(33-3)20(28)23(24,31)19(11)27/h6-8,20,26,28,31H,1-5H3/t20-,23-,24-/m1/s1
InChI key： QSPIPUXWSNFXCK-AGILITTLSA-N
SMILES： COC(=O)c1c(C)c2c(O)c3C(=O)[C@]4(OC)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,12-トリヒドロキシ-3,8,10aα-トリメトキシ-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,7,12-トリヒドロキシ-3,8,10a-トリメトキシ-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,7,12-trihydroxy-3,8,10a-trimethoxy-1-methyl-6,10,11-trioxo-6,6a,7,10,10a,11-hexahydrotetracene-2-carboxylate
Other name (3)：
  • (6aR)-6,6a,7,10,10a,11-Hexahydro-6aα,7α,12-trihydroxy-3,8,10aα-trimethoxy-1-methyl-6,10,11-trioxo-2-naphthacenecarboxylic acid methyl ester
  • Tetracenomycin X
  • テトラセノマイシンX
CAS registry number： 121245-07-6
KEGG COMPOUND： C12380
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