Chem
J-GLOBAL ID：201107043011110699   Nikkaji number：J2.953.491H

Leosibirone B

レオシビロンB
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： C22H34O7
Molecular formula furigana： C22-H34-O7
Molecular weight： 410.507
InChI： InChI=1S/C22H34O7/c1-12-16(25)17(26)18-19(3,4)14(28-13(2)23)6-7-20(18,5)22(12)9-8-21(29-22)10-15(24)27-11-21/h12,14-16,18,24-25H,6-11H2,1-5H3/t12-,14-,15+,16-,18+,20+,21+,22-/m1/s1
InChI key： MVQVPUNXXBZCSY-ZRHOJFANSA-N
SMILES： C[C@@H]1[C@@H](O)C(=O)[C@H]2C(C)(C)[C@@H](CC[C@]2(C)[C@]21CC[C@]1(CO[C@H](O)C1)O2)OC(=O)C
Systematic name  (3)：
  • (1R,2R,4aα,5′S,5′′S)-2α,5,5,8aβ-テトラメチル-3β,5′′-ジヒドロキシ-6α-アセトキシジスピロ[デカリン-1,2′-オキソラン-5′,3′′-オキソラン]-4-オン
  • (1R,2R,3R,4aS,5'S,5''S,6R,8aS)-3,5''-ジヒドロキシ-2,5,5,8a-テトラメチル-4-オキソ-オクタヒドロ-2H-ジスピロ[ナフタレン-1,2':5',3''-ビス(オキソラン)]-6-イル アセタート
  • (1R,2R,3R,4aS,5'S,5''S,6R,8aS)-3,5''-dihydroxy-2,5,5,8a-tetramethyl-4-oxo-octahydro-2H-dispiro[naphthalene-1,2':5',3''-bis(oxolane)]-6-yl acetate
Other name (3)：
  • (1R,2R,4aα,5′S,5′′S)-2α,5,5,8aβ-Tetramethyl-3β,5′′-dihydroxy-6α-acetoxydispiro[decalin-1,2′-oxolane-5′,3′′-oxolane]-4-one
  • レオシビロンB
  • Leosibirone B
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