Chem
J-GLOBAL ID：200907030531794954   Nikkaji number：J817.946H

Byzantionoside B

ビザンチオノシド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： C19H32O7
Molecular formula furigana： C19-H32-O7
Molecular weight： 372.458
InChI： InChI=1S/C19H32O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h7,11,13-18,20,22-24H,5-6,8-9H2,1-4H3/t11-,13-,14+,15+,16-,17+,18+/m0/s1
InChI key： NYLNHNDMNOPWAZ-CODAKJSOSA-N
SMILES： C[C@@H](CC[C@H]1C(=CC(=O)CC1(C)C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (4)：
  • (R)-3,5,5-トリメチル-4α-[(S)-3-(β-D-グルコピラノシルオキシ)ブチル]-2-シクロヘキセン-1-オン
  • (4R)-4α-[(S)-3-(β-D-グルコピラノシルオキシ)ブチル]-3,5,5-トリメチル-2-シクロヘキセン-1-オン
  • (4R)-3,5,5-トリメチル-4-[(3S)-3-{[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}ブチル]シクロヘキサ-2-エン-1-オン
  • (4R)-3,5,5-trimethyl-4-[(3S)-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butyl]cyclohex-2-en-1-one
Other name (5)：
  • Byzanthionoside B
  • (R)-3,5,5-Trimethyl-4α-[(S)-3-(β-D-glucopyranosyloxy)butyl]-2-cyclohexen-1-one
  • (4R)-4α-[(S)-3-(β-D-Glucopyranosyloxy)butyl]-3,5,5-trimethyl-2-cyclohexene-1-one
  • ビザンチオノシドB
  • Byzantionoside B
CAS registry number： 189109-45-3
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