Chem
J-GLOBAL ID：200907040299130098   Nikkaji number：J1.011.114E

(5α,12β,19α)-10α-Cyano-16-methoxy-2,3-didehydroaspidospermidine-3-carboxylic acid methyl ester

(5α,12β,19α)-10α-シアノ-16-メトキシ-2,3-ジデヒドロアスピドスペルミジン-3-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： C23H27N3O3
Molecular formula furigana： C23-H27-N3-O3
Molecular weight： 393.487
InChI： InChI=1S/C23H27N3O3/c1-4-22-8-5-9-26-14(13-24)11-23(21(22)26)17-7-6-15(28-2)10-18(17)25-19(23)16(12-22)20(27)29-3/h6-7,10,14,21,25H,4-5,8-9,11-12H2,1-3H3/t14-,21+,22+,23+/m1/s1
InChI key： KGYUBXKKFUGOFB-HZTRNQAASA-N
SMILES： CC[C@@]12CCCN3[C@H](C[C@@]4([C@H]13)C(=C(C2)C(=O)OC)Nc1cc(OC)ccc41)C#N
Systematic name  (3)：
  • (5α,12β,19α)-10α-シアノ-16-メトキシ-2,3-ジデヒドロアスピドスペルミジン-3-カルボン酸メチル
  • メチル (1R,12S,17R,19S)-17-シアノ-12-エチル-5-メトキシ-8,16-ジアザペンタシクロ[10.6.1.01,9.02,7.016,19]ノナデカ-2,4,6,9-テトラエン-10-カルボキシラート
  • methyl (1R,12S,17R,19S)-17-cyano-12-ethyl-5-methoxy-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,9-tetraene-10-carboxylate
Other name (1)：
  • (5α,12β,19α)-10α-Cyano-16-methoxy-2,3-didehydroaspidospermidine-3-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

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