Chem
J-GLOBAL ID：200907053144109062   Nikkaji number：J764.448E

(15S)-Scutecyprol A

(15S)-スクテシプロールA
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： C24H36O8
Molecular formula furigana： C24-H36-O8
Molecular weight： 452.544
InChI： InChI=1S/C24H36O8/c1-13-8-19(30-15(3)26)24(12-28-14(2)25)17(6-5-7-23(24)11-29-23)22(13,4)18-9-16-10-20(27)32-21(16)31-18/h13,16-21,27H,5-12H2,1-4H3/t13-,16+,17-,18+,19+,20+,21-,22+,23+,24+/m1/s1
InChI key： UXXDLTAQAXEQEL-KJXDMYTJSA-N
SMILES： C[C@@H]1C[C@H](OC(=O)C)[C@]2(COC(=O)C)[C@H](CCC[C@@]32CO3)[C@@]1(C)[C@@H]1C[C@H]2C[C@@H](O)O[C@H]2O1
Systematic name  (4)：
  • 酢酸[(1R,4aβ)-5β-[[(3aα,6aα)-5β-ヒドロキシヘキサヒドロフロ[2,3-b]フラン]-2α-イル]-5,6α-ジメチル-8aα-(アセトキシメチル)オクタヒドロスピロ[ナフタレン-1(2H),2′-オキシラン]]-8α-イル
  • (15S)-15α-ヒドロキシ-14,15-ジヒドロ-3-デオキシカリオプチノール
  • [(1R,4aR,5S,6R,8S,8aR)-5-[(2S,3aS,5S,6aR)-5-ヒドロキシ-ヘキサヒドロフロ[2,3-b]フラン-2-イル]-8-(アセチルオキシ)-5,6-ジメチル-オクタヒドロ-2H-スピロ[ナフタレン-1,2'-オキシラン]-8a-イル]メチル アセタート
  • [(1R,4aR,5S,6R,8S,8aR)-5-[(2S,3aS,5S,6aR)-5-hydroxy-hexahydrofuro[2,3-b]furan-2-yl]-8-(acetyloxy)-5,6-dimethyl-octahydro-2H-spiro[naphthalene-1,2'-oxiran]-8a-yl]methyl acetate
Other name (4)：
  • Acetic acid [(1R,4aβ)-5β-[[(3aα,6aα)-5β-hydroxyhexahydrofuro[2,3-b]furan]-2α-yl]-5,6α-dimethyl-8aα-(acetoxymethyl)octahydrospiro[naphthalene-1(2H),2′-oxiran]]-8α-yl ester
  • (15S)-15α-Hydroxy-14,15-dihydro-3-deoxycaryoptinol
  • (15S)-スクテシプロールA
  • (15S)-Scutecyprol A
CAS registry number： 176780-72-6
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