Chem
J-GLOBAL ID：200907041882355886   Nikkaji number：J8.347J

(1′β)-6′,7-Oxy-6,12′-dimethoxy-2′-methyloxyacanthan

(1′β)-6′,7-オキシ-6,12′-ジメトキシ-2′-メチルオキシアカンタン
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： C35H34N2O5
Molecular formula furigana： C35-H34-N2-O5
Molecular weight： 562.666
InChI： InChI=1S/C35H34N2O5/c1-37-13-11-22-17-30-31-19-25(22)27(37)15-21-6-9-28(38-2)29(16-21)40-24-7-4-20(5-8-24)14-26-33-23(10-12-36-26)18-32(39-3)34(41-30)35(33)42-31/h4-9,16-19,26-27,36H,10-15H2,1-3H3/t26-,27-/m0/s1
InChI key： XZAXGQMTBGFTFE-SVBPBHIXSA-N
SMILES： COc1ccc2C[C@@H]3N(C)CCc4cc5Oc6c(OC)cc7CCN[C@@H](Cc8ccc(Oc1c2)cc8)c7c6Oc5cc34
Systematic name  (3)：
  • (1′β)-6′,7-オキシ-6,12′-ジメトキシ-2′-メチルオキシアカンタン
  • (8S,21S)-13,27-ジメトキシ-7-メチル-15,29,31-トリオキサ-7,22-ジアザオクタシクロ[19.9.3.216,19.14,30.110,14.03,8.025,33.028,32]ヘプタトリアコンタ-1(30),2,4(34),10,12,14(37),16,18,25,27,32,35-ドデカエン
  • (8S,21S)-13,27-dimethoxy-7-methyl-15,29,31-trioxa-7,22-diazaoctacyclo[19.9.3.216,19.14,30.110,14.03,8.025,33.028,32]heptatriaconta-1(30),2,4(34),10,12,14(37),16,18,25,27,32,35-dodecaene
Other name (1)：
  • (1′β)-6′,7-Oxy-6,12′-dimethoxy-2′-methyloxyacanthan
KEGG COMPOUND： C09669
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