Chem
J-GLOBAL ID：200907062259199749   Nikkaji number：J2.354.396F

Deacetoxyvindoline

デスアセトキシビンドリン
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： C23H30N2O4
Molecular formula furigana： C23-H30-N2-O4
Molecular weight： 398.503
InChI： InChI=1S/C23H30N2O4/c1-5-21-9-6-11-25-12-10-22(18(21)25)16-8-7-15(28-3)13-17(16)24(2)19(22)23(27,14-21)20(26)29-4/h6-9,13,18-19,27H,5,10-12,14H2,1-4H3/t18-,19+,21-,22+,23+/m0/s1
InChI key： WNKDGPXNFMMOEJ-RNJSZURPSA-N
SMILES： CC[C@@]12C[C@@](O)([C@@H]3N(C)c4cc(OC)ccc4[C@]43CCN(CC=C1)[C@@H]24)C(=O)OC
Systematic name  (4)：
  • (2β,5α,12β,19α)-1-メチル-3β-ヒドロキシ-16-メトキシ-6,7-ジデヒドロアスピドスペルミジン-3-カルボン酸メチル
  • (2β,5α,12β,19α)-3β-ヒドロキシ-6,7-ジデヒドロ-16-メトキシ-1-メチルアスピドスペルミジン-3-カルボン酸メチル
  • メチル (1R,9R,10R,12R,19S)-12-エチル-10-ヒドロキシ-5-メトキシ-8-メチル-8,16-ジアザペンタシクロ[10.6.1.01,9.02,7.016,19]ノナデカ-2,4,6,13-テトラエン-10-カルボキシラート
  • methyl (1R,9R,10R,12R,19S)-12-ethyl-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate
Other name (9)：
  • (2β,5α,12β,19α)-1-Methyl-3β-hydroxy-16-methoxy-6,7-didehydroaspidospermidine-3-carboxylic acid methyl ester
  • (+)-4-デスアセトキシビンドリン
  • (+)-4-Desacetoxyvindoline
  • (2β,5α,12β,19α)-3β-Hydroxy-6,7-didehydro-16-methoxy-1-methylaspidospermidine-3-carboxylic acid methyl ester
  • Desacetoxyvindoline
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KEGG COMPOUND： C02673
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