Chem
J-GLOBAL ID:200907027673824965   Nikkaji number:J758.411C

Robinetinidol-(4α-8)-gallocatechin

ロビネチニドール-(4α-8)-ガロカテキン
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: C30H26O13
Molecular formula furigana: C30-H26-O13
Molecular weight: 594.525
InChI: InChI=1S/C30H26O13/c31-12-1-2-13-22(7-12)42-29(11-5-19(36)26(40)20(37)6-11)27(41)23(13)24-16(33)9-15(32)14-8-21(38)28(43-30(14)24)10-3-17(34)25(39)18(35)4-10/h1-7,9,21,23,27-29,31-41H,8H2/t21-,23-,27-,28+,29+/m0/s1
InChI key: KQBOEJCDGYYZJZ-ITCYIJQVSA-N
SMILES: O[C@H]1Cc2c(O)cc(O)c([C@H]3[C@H](O)[C@H](Oc4cc(O)ccc34)c3cc(O)c(O)c(O)c3)c2O[C@@H]1c1cc(O)c(O)c(O)c1
Systematic name  (4):
  • (2R,2′R)-2α,2′α-ビス(3,4,5-トリヒドロキシフェニル)-4α,8′-ビクロマン-3β,3′β,5′,7,7′-ペンタオール
  • (2R)-2α-(3,4,5-トリヒドロキシフェニル)-4α-[(2R)-2α-(3,4,5-トリヒドロキシフェニル)-3β,5,7-トリヒドロキシ-3,4-ジヒドロ-2H-1-ベンゾピラン-8-イル]-3,4-ジヒドロ-2H-1-ベンゾピラン-3β,7-ジオール
  • (2R,3S)-8-[(2R,3S,4S)-3,7-ジヒドロキシ-2-(3,4,5-トリヒドロキシフェニル)-3,4-ジヒドロ-2H-1-ベンゾピラン-4-イル]-2-(3,4,5-トリヒドロキシフェニル)-3,4-ジヒドロ-2H-1-ベンゾピラン-3,5,7-トリオール
  • (2R,3S)-8-[(2R,3S,4S)-3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
Other name (6):
  • ロビネチニドール-(4α→8)-ガロカテキン
  • Robinetinidol-(4α→8)-gallocatechin
  • (2R,2′R)-2α,2′α-Bis(3,4,5-trihydroxyphenyl)-4α,8′-bichroman-3β,3′β,5′,7,7′-pentol
  • (2R)-2α-(3,4,5-Trihydroxyphenyl)-4α-[(2R)-2α-(3,4,5-trihydroxyphenyl)-3β,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-3,4-dihydro-2H-1-benzopyran-3β,7-diol
  • Robinetinidol-(4α-8)-gallocatechin
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