Chem
J-GLOBAL ID：200907075972524476   Nikkaji number：J2.136.951I

14,15β:20,21α-Diepoxy-5β,14β-bufanolide-22-ene-3β-ol

14,15β:20,21α-ジエポキシ-5β,14β-ブファノリド-22-エン-3β-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： C24H32O5
Molecular formula furigana： C24-H32-O5
Molecular weight： 400.515
InChI： InChI=1S/C24H32O5/c1-21-8-5-14(25)11-13(21)3-4-16-15(21)6-9-22(2)17(12-18-24(16,22)28-18)23-10-7-19(26)27-20(23)29-23/h7,10,13-18,20,25H,3-6,8-9,11-12H2,1-2H3/t13-,14+,15+,16-,17+,18-,20+,21+,22-,23+,24-/m1/s1
InChI key： JZDMFDWKCWMAMI-CCZSFDDYSA-N
SMILES： C[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@]34C)[C@@]31O[C@@H]3C[C@@H]2[C@]12O[C@@H]1OC(=O)C=C2
Systematic name  (3)：
  • 14,15β:20,21α-ジエポキシ-5β,14β-ブファノリド-22-エン-3β-オール
  • (1R,6S)-6-[(1R,2S,4R,6S,7R,10S,11S,14S,16R)-14-ヒドロキシ-7,11-ジメチル-3-オキサペンタシクロ[8.8.0.02,4.02,7.011,16]オクタデカン-6-イル]-2,7-ジオキサビシクロ[4.1.0]ヘプタ-4-エン-3-オン
  • (1R,6S)-6-[(1R,2S,4R,6S,7R,10S,11S,14S,16R)-14-hydroxy-7,11-dimethyl-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadecan-6-yl]-2,7-dioxabicyclo[4.1.0]hept-4-en-3-one
Other name (1)：
  • 14,15β:20,21α-Diepoxy-5β,14β-bufanolide-22-ene-3β-ol
Thsaurus map：
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