Chem
J-GLOBAL ID：200907081162422421   Nikkaji number：J668.703B

3-Methyl-6-propyl-5,6,6aβ,7,8,12bα-hexahydrobenzo[a]phenanthridine-10,11-diol

3-メチル-6-プロピル-5,6,6aβ,7,8,12bα-ヘキサヒドロベンゾ[a]フェナントリジン-10,11-ジオール
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： C21H25NO2
Molecular formula furigana： C21-H25-N-O2
Molecular weight： 323.436
InChI： InChI=1S/C21H25NO2/c1-3-8-22-12-15-9-13(2)4-6-16(15)21-17-11-20(24)19(23)10-14(17)5-7-18(21)22/h4,6,9-11,18,21,23-24H,3,5,7-8,12H2,1-2H3/t18-,21-/m1/s1
InChI key： IFODQCSLFYJCSE-WIYYLYMNSA-N
SMILES： CCCN1Cc2cc(C)ccc2[C@H]2[C@H]1CCc1cc(O)c(O)cc21
Systematic name  (3)：
  • 3-メチル-6-プロピル-5,6,6aβ,7,8,12bα-ヘキサヒドロベンゾ[a]フェナントリジン-10,11-ジオール
  • (6aR,12bS)-3-メチル-6-プロピル-5H,6H,6aH,7H,8H,12bH-ベンゾ[a]フェナントリジン-10,11-ジオール
  • (6aR,12bS)-3-methyl-6-propyl-5H,6H,6aH,7H,8H,12bH-benzo[a]phenanthridine-10,11-diol
Other name (1)：
  • 3-Methyl-6-propyl-5,6,6aβ,7,8,12bα-hexahydrobenzo[a]phenanthridine-10,11-diol
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