Chem
J-GLOBAL ID：200907068341990568   Nikkaji number：J830.188C

1,11-Dimethoxy-3-methyl-8,13-dioxo-9-hydroxy-5,6,8,13-tetrahydrobenzo[a]naphthacene-2-carboxylic acid methyl ester

1,11-ジメトキシ-3-メチル-8,13-ジオキソ-9-ヒドロキシ-5,6,8,13-テトラヒドロベンゾ[a]ナフタセン-2-カルボン酸メチル
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： C27H22O7
Molecular formula furigana： C27-H22-O7
Molecular weight： 458.466
InChI： InChI=1S/C27H22O7/c1-12-7-14-6-5-13-8-17-18(11-16(13)22(14)26(33-3)21(12)27(31)34-4)24(29)19-9-15(32-2)10-20(28)23(19)25(17)30/h7-11,28H,5-6H2,1-4H3
InChI key： CLWNUVTVRKMFAE-UHFFFAOYSA-N
SMILES： COC(=O)c1c(C)cc2CCc3cc4C(=O)c5c(O)cc(OC)cc5C(=O)c4cc3c2c1OC
Systematic name  (4)：
  • 1,11-ジメトキシ-5,6,8,13-テトラヒドロ-9-ヒドロキシ-3-メチル-8,13-ジオキソベンゾ[a]ナフタセン-2-カルボン酸メチル
  • 1,11-ジメトキシ-3-メチル-8,13-ジオキソ-9-ヒドロキシ-5,6,8,13-テトラヒドロベンゾ[a]ナフタセン-2-カルボン酸メチル
  • メチル 17-ヒドロキシ-5,19-ジメトキシ-7-メチル-15,22-ジオキソペンタシクロ[12.8.0.03,12.04,9.016,21]ドコサ-1(14),2,4,6,8,12,16,18,20-ノナエン-6-カルボキシラート
  • methyl 17-hydroxy-5,19-dimethoxy-7-methyl-15,22-dioxopentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(14),2,4,6,8,12,16,18,20-nonaene-6-carboxylate
Other name (1)：
  • 1,11-Dimethoxy-3-methyl-8,13-dioxo-9-hydroxy-5,6,8,13-tetrahydrobenzo[a]naphthacene-2-carboxylic acid methyl ester
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