Chem
J-GLOBAL ID：200907018304011501   Nikkaji number：J937.211C

[(1S,3S,5aS)-5,5a,6,7,8,8aβ-Hexahydro-3,8α-methano-6β,7β-epoxy-1H-cyclopenta[e][1,3]dioxepin]-1-yl β-D-glucopyranoside

[(1S,3S,5aS)-5,5a,6,7,8,8aβ-ヘキサヒドロ-3,8α-メタノ-6β,7β-エポキシ-1H-シクロペンタ[e][1,3]ジオキセピン]-1-イルβ-D-グルコピラノシド
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： C15H22O9
Molecular formula furigana： C15-H22-O9
Molecular weight： 346.332
InChI： InChI=1S/C15H22O9/c16-2-6-9(17)10(18)11(19)15(21-6)24-14-8-4-1-7(22-14)20-3-5(8)13-12(4)23-13/h4-19H,1-3H2/t4-,5-,6-,7+,8+,9-,10+,11-,12+,13-,14+,15+/m1/s1
InChI key： LIZQONOPKAHKJW-VXVVEQRTSA-N
SMILES： OC[C@H]1O[C@@H](O[C@@H]2O[C@H]3C[C@H]4[C@@H]5O[C@@H]5[C@H](CO3)[C@@H]24)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • [(1S,3S,5aS)-5,5a,6,7,8,8aβ-ヘキサヒドロ-3,8α-メタノ-6β,7β-エポキシ-1H-シクロペンタ[e][1,3]ジオキセピン]-1-イルβ-D-グルコピラノシド
  • (2R,3S,4S,5R,6S)-2-(ヒドロキシメチル)-6-[(1R,2S,4R,5S,8S,10S,11S)-3,7,9-トリオキサテトラシクロ[6.3.1.02,4.05,11]ドデカン-10-イルオキシ]オキサン-3,4,5-トリオール
  • (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[(1R,2S,4R,5S,8S,10S,11S)-3,7,9-trioxatetracyclo[6.3.1.02,4.05,11]dodecan-10-yloxy]oxane-3,4,5-triol
Other name (1)：
  • [(1S,3S,5aS)-5,5a,6,7,8,8aβ-Hexahydro-3,8α-methano-6β,7β-epoxy-1H-cyclopenta[e][1,3]dioxepin]-1-yl β-D-glucopyranoside
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