Chem
J-GLOBAL ID：200907070617061102   Nikkaji number：J739.537J

Pyripyropene N

ピリピロペンN
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： C31H39NO8
Molecular formula furigana： C31-H39-N-O8
Molecular weight： 553.652
InChI： InChI=1S/C31H39NO8/c1-6-23(33)37-17-30(4)21-10-13-31(5)27(29(21,3)12-11-22(30)39-24(34)7-2)26(35)25-20(40-31)15-19(38-28(25)36)18-9-8-14-32-16-18/h8-9,14-16,21-22,26-27,35H,6-7,10-13,17H2,1-5H3/t21-,22+,26+,27-,29+,30+,31-/m1/s1
InChI key： JXQHKJNUBWQYRK-VDRJQMDKSA-N
SMILES： CCC(=O)OC[C@]1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@@]1(C)Oc3cc(oc(=O)c3[C@H](O)[C@H]21)c1cccnc1)OC(=O)CC
Systematic name  (3)：
  • 1,3,4,4aβ,5,6,6a,12,12aβ,12b-デカヒドロ-4,6aα,12bα-トリメチル-9-(3-ピリジニル)-12α-ヒドロキシ-3α-(プロピオニルオキシ)-4β-(プロピオニルオキシメチル)-2H,11H-ナフト[2,1-b]ピラノ[3,4-e]ピラン-11-オン
  • [(5aR,7aR,8R,9S,11aS,11bS,12R)-12-ヒドロキシ-5a,8,11a-トリメチル-1-オキソ-9-(プロパノイルオキシ)-3-(ピリジン-3-イル)-1,5a,6,7,7a,8,9,10,11,11a,11b,12-ドデカヒドロ-2,5-ジオキサテトラフェン-8-イル]メチル プロパノアート
  • [(5aR,7aR,8R,9S,11aS,11bS,12R)-12-hydroxy-5a,8,11a-trimethyl-1-oxo-9-(propanoyloxy)-3-(pyridin-3-yl)-1,5a,6,7,7a,8,9,10,11,11a,11b,12-dodecahydro-2,5-dioxatetraphen-8-yl]methyl propanoate
Other name (3)：
  • ピリピロペンN
  • Pyripyropene N
  • 1,3,4,4aβ,5,6,6a,12,12aβ,12b-Decahydro-4,6aα,12bα-trimethyl-9-(3-pyridinyl)-12α-hydroxy-3α-(propionyloxy)-4β-(propionyloxymethyl)-2H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-11-one
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