Chem
J-GLOBAL ID：201207014923031444   Nikkaji number：J3.029.154I

(3S)-3β-(β-D-Glucopyranosyloxy)-3,3aβ,4,5,9aβ,9bα-hexahydro-3,6,9-trimethylazuleno[4,5-b]furan-2,7-dione

(3S)-3β-(β-D-グルコピラノシルオキシ)-3,3aβ,4,5,9aβ,9bα-ヘキサヒドロ-3,6,9-トリメチルアズレノ[4,5-b]フラン-2,7-ジオン
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： C21H28O9
Molecular formula furigana： C21-H28-O9
Molecular weight： 424.446
InChI： InChI=1S/C21H28O9/c1-8-4-5-10-18(14-9(2)6-11(23)13(8)14)29-20(27)21(10,3)30-19-17(26)16(25)15(24)12(7-22)28-19/h6,10,12,14-19,22,24-26H,4-5,7H2,1-3H3/t10-,12-,14+,15-,16+,17-,18+,19+,21+/m1/s1
InChI key： FVSUVYLVYCAWSC-IAVMJGCASA-N
SMILES： CC1=CC(=O)C2=C(C)CC[C@@H]3[C@H](OC(=O)[C@@]3(C)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12
Systematic name  (3)：
  • (3S)-3β-(β-D-グルコピラノシルオキシ)-3,3aβ,4,5,9aβ,9bα-ヘキサヒドロ-3,6,9-トリメチルアズレノ[4,5-b]フラン-2,7-ジオン
  • (3S,3aR,9aS,9bR)-3,6,9-トリメチル-3-{[(2S,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}-2H,3H,3aH,4H,5H,7H,9aH,9bH-アズレノ[4,5-b]フラン-2,7-ジオン
  • (3S,3aR,9aS,9bR)-3,6,9-trimethyl-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,3H,3aH,4H,5H,7H,9aH,9bH-azuleno[4,5-b]furan-2,7-dione
Other name (1)：
  • (3S)-3β-(β-D-Glucopyranosyloxy)-3,3aβ,4,5,9aβ,9bα-hexahydro-3,6,9-trimethylazuleno[4,5-b]furan-2,7-dione
Thsaurus map：
Thesaurus Map

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