Chem
J-GLOBAL ID：200907045116812871   Nikkaji number：J1.319.352E

Carlinoside

カルリノシド
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： C26H28O15
Molecular formula furigana： C26-H28-O15
Molecular weight： 580.495
InChI： InChI=1S/C26H28O15/c27-5-13-18(33)21(36)23(38)26(41-13)15-19(34)14-10(30)4-12(7-1-2-8(28)9(29)3-7)40-24(14)16(20(15)35)25-22(37)17(32)11(31)6-39-25/h1-4,11,13,17-18,21-23,25-29,31-38H,5-6H2/t11-,13+,17-,18+,21-,22+,23+,25-,26-/m0/s1
InChI key： XBGYTZHKGMCEGE-VYUBKLCTSA-N
SMILES： OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1c(O)c([C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c2oc(cc(=O)c2c1O)c1ccc(O)c(O)c1
Systematic name  (4)：
  • 3′,4′,5,7-テトラヒドロキシ-6-(β-D-グルコピラノシル)-8-(α-L-アラビノピラノシル)フラボン
  • 8-α-L-アラビノピラノシル-2-(3,4-ジヒドロキシフェニル)-6-β-D-グルコピラノシル-5,7-ジヒドロキシ-4H-1-ベンゾピラン-4-オン
  • 2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-6-[(2S,3R,4R,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]-8-[(2S,3R,4S,5S)-3,4,5-トリヒドロキシオキサン-2-イル]-4H-クロメン-4-オン
  • 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]-4H-chromen-4-one
Other name (4)：
  • 3′,4′,5,7-Tetrahydroxy-6-(β-D-glucopyranosyl)-8-(α-L-arabinopyranosyl)flavone
  • 8-α-L-Arabinopyranosyl-2-(3,4-dihydroxyphenyl)-6-β-D-glucopyranosyl-5,7-dihydroxy-4H-1-benzopyran-4-one
  • カルリノシド
  • Carlinoside
CAS registry number： 59952-97-5
KEGG COMPOUND： C10026
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