Chem
J-GLOBAL ID：200907006416049457   Nikkaji number：J2.165.218K

Decaturin D

デカツリンD
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： C30H35NO4
Molecular formula furigana： C30-H35-N-O4
Molecular weight： 473.613
InChI： InChI=1S/C30H35NO4/c1-18-8-9-24-28(4)12-11-25(32)27(2,3)23(28)10-13-29(24,5)30(18)16-20-22(35-30)15-21(34-26(20)33)19-7-6-14-31-17-19/h6-8,14-15,17,23-24H,9-13,16H2,1-5H3/t23-,24+,28-,29+,30-/m0/s1
InChI key： AHYSWFBBMLPXFU-XBRQCBKPSA-N
SMILES： CC1=CC[C@@H]2[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]2(C)[C@@]21Cc1c(O2)cc(oc1=O)c1cccnc1
Systematic name  (4)：
  • (2S)-3′,4′,4′a,4′bα,8′a,9′,10′,10′aα-オクタヒドロ-1′,1′,4′aβ,7′,8′aβ-ペンタメチル-6-(3-ピリジル)スピロ[4H-フロ[3,2-c]ピラン-2(3H),8′(5′H)-フェナントレン]-2′,4(1′H)-ジオン
  • (2S,4′aR,4′bR,8′aR,10′aR)-4′a,5′,6′,8′,8′a,9′,10′,10′a-オクタヒドロ-2′,4′b,8′,8′,10′a-ペンタメチル-6-(3-ピリジニル)-スピロ[4H-フロ[3,2-c]ピラン-2(3H),1′(4′H)-フェナントレン]-4,7′(4′bH)-ジオン
  • (2S,4'aR,4'bR,8'aR,10'aR)-2',4'b,8',8',10'a-ペンタメチル-6-(ピリジン-3-イル)-3,4,4'a,4'b,5',6',7',8',8'a,9',10',10'a-ドデカヒドロ-4'H-スピロ[フロ[3,2-c]ピラン-2,1'-フェナントレン]-4,7'-ジオン
  • (2S,4'aR,4'bR,8'aR,10'aR)-2',4'b,8',8',10'a-pentamethyl-6-(pyridin-3-yl)-3,4,4'a,4'b,5',6',7',8',8'a,9',10',10'a-dodecahydro-4'H-spiro[furo[3,2-c]pyran-2,1'-phenanthrene]-4,7'-dione
Other name (4)：
  • (2S)-3′,4′,4′a,4′bα,8′a,9′,10′,10′aα-Octahydro-1′,1′,4′aβ,7′,8′aβ-pentamethyl-6-(3-pyridyl)spiro[4H-furo[3,2-c]pyran-2(3H),8′(5′H)-phenanthrene]-2′,4(1′H)-dione
  • デカツリンD
  • Decaturin D
  • (2S,4′aR,4′bR,8′aR,10′aR)-4′a,5′,6′,8′,8′a,9′,10′,10′a-Octahydro-2′,4′b,8′,8′,10′a-pentamethyl-6-(3-pyridinyl)-spiro[4H-furo[3,2-c]pyran-2(3H),1′(4′H)-phenanthrene]-4,7′(4′bH)-dione
CAS registry number： 849339-60-2
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