Chem
J-GLOBAL ID：200907049254074690   Nikkaji number：J1.011.118H

(5α,12β,19α)-10α-Cyano-16-methoxy-2,3,6,7-tetradehydroaspidospermidine-3-carboxylic acid methyl ester

(5α,12β,19α)-10α-シアノ-16-メトキシ-2,3,6,7-テトラ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： C23H25N3O3
Molecular formula furigana： C23-H25-N3-O3
Molecular weight： 391.471
InChI： InChI=1S/C23H25N3O3/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/h5-8,10,14,21,25H,4,9,11-12H2,1-3H3/t14-,21+,22+,23+/m1/s1
InChI key： LYUUVDYMVHXFOF-HZTRNQAASA-N
SMILES： CC[C@@]12CC(=C3Nc4cc(OC)ccc4[C@]43C[C@H](C#N)N(CC=C1)[C@@H]24)C(=O)OC
Systematic name  (3)：
  • (5α,12β,19α)-10α-シアノ-16-メトキシ-2,3,6,7-テトラ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,12R,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-2,4,6,9,13-ペンタエン-10-カルボキシラート
  • methyl (1R,12R,17R,19S)-17-cyano-12-ethyl-5-methoxy-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,9,13-pentaene-10-carboxylate
Other name (1)：
  • (5α,12β,19α)-10α-Cyano-16-methoxy-2,3,6,7-tetradehydroaspidospermidine-3-carboxylic acid methyl ester
Thsaurus map：
Thesaurus Map

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