Chem
J-GLOBAL ID：200907082845090846   Nikkaji number：J16.423B

Preakuammicine

プレアクアンミシン
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： C21H24N2O3
Molecular formula furigana： C21-H24-N2-O3
Molecular weight： 352.434
InChI： InChI=1S/C21H24N2O3/c1-3-13-11-23-9-8-20-14-6-4-5-7-16(14)22-18(20)21(12-24,19(25)26-2)15(13)10-17(20)23/h3-7,15,17,24H,8-12H2,1-2H3/b13-3-/t15-,17-,20?,21?/m0/s1
InChI key： DSOCELULQRKOMA-BVVZCPEOSA-N
SMILES： COC(=O)C1(CO)[C@H]2C[C@@H]3N(CCC43C1=Nc1ccccc41)C/C/2=C/C
Systematic name  (3)：
  • (16ξ,19E)-1,2,19,20-テトラデヒドロ-17-ヒドロキシクラン-16-カルボン酸メチル
  • メチル (11S,12E,17S)-12-エチリデン-10-(ヒドロキシメチル)-8,14-ジアザペンタシクロ[9.5.2.01,9.02,7.014,17]オクタデカ-2,4,6,8-テトラエン-10-カルボキシラート
  • methyl (11S,12E,17S)-12-ethylidene-10-(hydroxymethyl)-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,8-tetraene-10-carboxylate
Other name (3)：
  • プレアクアンミシン
  • Preakuammicine
  • (16ξ,19E)-1,2,19,20-Tetradehydro-17-hydroxycuran-16-carboxylic acid methyl ester
CAS registry number： 23924-90-5
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