Chem
J-GLOBAL ID：200907017039692910   Nikkaji number：J15.235H

Actinodaphnine

アクチノダフニン
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： C18H17NO4
Molecular formula furigana： C18-H17-N-O4
Molecular weight： 311.337
InChI： InChI=1S/C18H17NO4/c1-21-14-7-11-10(5-13(14)20)4-12-16-9(2-3-19-12)6-15-18(17(11)16)23-8-22-15/h5-7,12,19-20H,2-4,8H2,1H3/t12-/m0/s1
InChI key： VYJUHRAQPIBWNV-LBPRGKRZSA-N
SMILES： COc1cc2c(C[C@@H]3NCCc4cc5OCOc5c2c34)cc1O
Systematic name  (4)：
  • (7aS)-6,7,7a,8-テトラヒドロ-11-メトキシ-5H-ベンゾ[g]-1,3-ベンゾジオキソロ[6,5,4-de]キノリン-10-オール
  • (-)-1,2-メチレンジオキシ-10-メトキシ-5,6,6aα,7-テトラヒドロ-4H-ジベンゾ[de,g]キノリン-9-オール
  • (12S)-17-メトキシ-3,5-ジオキサ-11-アザペンタシクロ[10.7.1.02,6.08,20.014,19]イコサ-1(20),2(6),7,14(19),15,17-ヘキサエン-16-オール
  • (12S)-17-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-16-ol
Other name (5)：
  • アクチノダフニン
  • Actinodaphnine
  • (7aS)-6,7,7a,8-Tetrahydro-11-methoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol
  • (-)-1,2-Methylenedioxy-10-methoxy-5,6,6aα,7-tetrahydro-4H-dibenzo[de,g]quinoline-9-ol
  • (-)-アノロビン
CAS registry number： 517-69-1
KEGG COMPOUND： C09322
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