Chem
J-GLOBAL ID：200907092073328006   Nikkaji number：J1.955.436H

23-Oxo-21ξ-hydroxy-21,23-dihydroveprisone

23-オキソ-21ξ-ヒドロキシ-21,23-ジヒドロベプリソン
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： C27H34O10
Molecular formula furigana： C27-H34-O10
Molecular weight： 518.558
InChI： InChI=1S/C27H34O10/c1-23(2)14-10-15(28)26(5)13(25(14,4)16(36-23)11-17(29)33-6)7-8-24(3)19(12-9-18(30)34-21(12)31)35-22(32)20-27(24,26)37-20/h9,13-14,16,19-21,31H,7-8,10-11H2,1-6H3/t13-,14+,16+,19+,20-,21?,24+,25-,26+,27-/m1/s1
InChI key： SAOLXGKDXTUSRH-RULWPXFASA-N
SMILES： COC(=O)C[C@@H]1OC(C)(C)[C@@H]2CC(=O)[C@]3(C)[C@H](CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@@]345)C3=CC(=O)OC3O)[C@@]12C
Systematic name  (3)：
  • 2-デカルボキシ-2-(メトキシカルボニル)-19-デオキシ-21,23-ジヒドロ-21ξ-ヒドロキシ-23-オキソリモン酸16,17-ラクトン
  • メチル 2-[(1R,2R,4S,7R,8S,11R,12R,13S,16R)-7-(2-ヒドロキシ-5-オキソ-2,5-ジヒドロフラン-3-イル)-1,8,12,15,15-ペンタメチル-5,18-ジオキソ-3,6,14-トリオキサペンタシクロ[9.7.0.02,4.02,8.012,16]オクタデカン-13-イル]アセタート
  • methyl 2-[(1R,2R,4S,7R,8S,11R,12R,13S,16R)-7-(2-hydroxy-5-oxo-2,5-dihydrofuran-3-yl)-1,8,12,15,15-pentamethyl-5,18-dioxo-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecan-13-yl]acetate
Other name (3)：
  • 2-Decarboxy-2-(methoxycarbonyl)-19-deoxy-21,23-dihydro-21ξ-hydroxy-23-oxolimonoic acid 16,17-lactone
  • 23-オキソ-21ξ-ヒドロキシ-21,23-ジヒドロベプリソン
  • 23-Oxo-21ξ-hydroxy-21,23-dihydroveprisone
Thsaurus map：
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