Chem
J-GLOBAL ID：200907039319722401   Nikkaji number：J12.356K

Obamegine

オバメギン
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： C36H38N2O6
Molecular formula furigana： C36-H38-N2-O6
Molecular weight： 594.708
InChI： InChI=1S/C36H38N2O6/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)15-21-5-8-25(9-6-21)43-30-17-22(7-10-29(30)39)16-28-34-24(12-14-38(28)2)19-33(42-4)35(40)36(34)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28+/m0/s1
InChI key： XGEAUXVPBXUBKN-WUFINQPMSA-N
SMILES： COc1cc2CCN(C)[C@@H]3Cc4ccc(O)c(Oc5ccc(C[C@@H]6N(C)CCc7cc(OC)c(Oc(c1O)c23)cc67)cc5)c4
Systematic name  (3)：
  • 6,6′-ジメトキシ-2,2′-ジメチルベルバマン-7,12-ジオール
  • (1S,14R)-20,25-ジメトキシ-15,30-ジメチル-7,23-ジオキサ-15,30-ジアザヘプタシクロ[22.6.2.23,6.18,12.114,18.027,31.022,33]ヘキサトリアコンタ-3,5,8(34),9,11,18(33),19,21,24,26,31,35-ドデカエン-9,21-ジオール
  • (1S,14R)-20,25-dimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3,5,8(34),9,11,18(33),19,21,24,26,31,35-dodecaene-9,21-diol
Other name (5)：
  • オバメギン
  • ステホリン
  • Obamegine
  • Stepholine
  • 6,6′-Dimethoxy-2,2′-dimethylberbaman-7,12-diol
CAS registry number： 479-37-8
KEGG COMPOUND： C06513
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