Chem
J-GLOBAL ID：201107055681307661   Nikkaji number：J2.897.809J

3′-Methoxyprocyanidin B2

3′-メトキシプロシアニジンB2
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： C31H28O12
Molecular formula furigana： C31-H28-O12
Molecular weight： 592.553
InChI： InChI=1S/C31H28O12/c1-41-24-10-15-18(35)11-22(39)26(31(15)43-29(24)12-2-4-16(33)19(36)6-12)27-25-21(38)8-14(32)9-23(25)42-30(28(27)40)13-3-5-17(34)20(37)7-13/h2-9,11,24,27-30,32-40H,10H2,1H3/t24-,27-,28-,29-,30-/m1/s1
InChI key： WKXLCOFMDHKLPF-WVUACWIUSA-N
SMILES： CO[C@@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4cc(O)cc(O)c34)c3ccc(O)c(O)c3)c2O[C@@H]1c1ccc(O)c(O)c1
Systematic name  (4)：
  • 3′α-メトキシ-2α,2′α-ビス(3,4-ジヒドロキシフェニル)-3,3′,4,4′-テトラヒドロ-4β,8′-ビ(2H-1-ベンゾピラン)-3α,5,5′,7,7′-ペンタオール
  • (2R,2′R,3R,3′R,4R)-3′-メトキシ-2,2′-ビス(3,4-ジヒドロキシフェニル)-3,3′,4,4′-テトラヒドロ-4,8′-ビ(2H-1-ベンゾピラン)-3,5,5′,7,7′-ペンタオール
  • (2R,3R,4R)-2-(3,4-ジヒドロキシフェニル)-4-[(2R,3R)-2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-3-メトキシ-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-3,5,7-トリオール
  • (2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-3,4-dihydro-2H-1-benzopyran-8-yl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
Other name (4)：
  • 3′α-Methoxy-2α,2′α-bis(3,4-dihydroxyphenyl)-3,3′,4,4′-tetrahydro-4β,8′-bi(2H-1-benzopyran)-3α,5,5′,7,7′-pentaol
  • 3′-メトキシプロシアニジンB2
  • 3′-Methoxyprocyanidin B2
  • (2R,2′R,3R,3′R,4R)-3′-Methoxy-2,2′-bis(3,4-dihydroxyphenyl)-3,3′,4,4′-tetrahydro-4,8′-bi(2H-1-benzopyran)-3,5,5′,7,7′-pentaol
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