Chem
J-GLOBAL ID：200907023511750679   Nikkaji number：J2.193.211F

2-[[(3aR,8aS)-3a-Hydroxy-3,3a,8,8a-tetrahydro-2H-furo[2,3-b]indole-8-yl]methyl]-2-methyl-4-[(1,1-3H2)butyl]-5-[(3H2)methyl]-4-cyclopentene-1,3-dione

2-{[(3aR,8aS)-3a-ヒドロキシ-2H,3H,3aH,8H,8aH-フロ[2,3-b]インドール-8-イル]メチル}-4-[(1,1-3H2)ブチル]-5-(3H2)メチル-2-メチルシクロペンタ-4-エン-1,3-ジオン
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： C22H23[3H]4NO4
Molecular formula furigana： C22-H27-N-O4
Molecular weight： 377.493
InChI： InChI=1S/C22H27NO4/c1-4-5-8-15-14(2)18(24)21(3,19(15)25)13-23-17-10-7-6-9-16(17)22(26)11-12-27-20(22)23/h6-7,9-10,20,26H,4-5,8,11-13H2,1-3H3/t20-,21?,22+/m0/s1/i2T2,8T2
InChI key： XPVQXXLKOCZMGG-KFNTWUBBSA-N
SMILES： C([3H])([3H])C1=C(C(=O)C(C)(CN2[C@H]3OCC[C@@]3(O)c3ccccc23)C1=O)C([3H])([3H])CCC
Systematic name  (3)：
  • 2-[[(3aR,8aS)-3a-ヒドロキシ-3,3a,8,8a-テトラヒドロ-2H-フロ[2,3-b]インドール-8-イル]メチル]-2-メチル-4-[(1,1-3H2)ブチル]-5-[(3H2)メチル]-4-シクロペンテン-1,3-ジオン
  • 2-{[(3aR,8aS)-3a-ヒドロキシ-2H,3H,3aH,8H,8aH-フロ[2,3-b]インドール-8-イル]メチル}-4-[(1,1-3H2)ブチル]-5-(3H2)メチル-2-メチルシクロペンタ-4-エン-1,3-ジオン
  • 2-{[(3aR,8aS)-3a-hydroxy-2H,3H,3aH,8H,8aH-furo[2,3-b]indol-8-yl]methyl}-4-[(1,1-3H2)butyl]-5-(3H2)methyl-2-methylcyclopent-4-ene-1,3-dione
Other name (1)：
  • 2-[[(3aR,8aS)-3a-Hydroxy-3,3a,8,8a-tetrahydro-2H-furo[2,3-b]indole-8-yl]methyl]-2-methyl-4-[(1,1-3H2)butyl]-5-[(3H2)methyl]-4-cyclopentene-1,3-dione
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