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Substance Name: Procyanidin B1
RN: 20315-25-7
UNII: 0566J48E7X
InChIKey: XFZJEEAOWLFHDH-UKWJTHFESA-N

Molecular Formula

  • C30-H26-O12

Molecular Weight

  • 578.5234
 
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Names and Synonyms

Name of Substance

  • Procyanidin B1

Synonyms

  • 2,2'-Bis(3,4-dihydroxyphenyl)-3,3',4,4'-tetrahydro-(4,8-Bi-2H-1-benzopyran)-3,3',5,5',7,7'-hexol
  • UNII-0566J48E7X

Systematic Name

  • (4,8-Bi-2H-1-benzopyran)-3,3',5,5',7,7'-hexol, 2,2'-bis(3,4-dihydroxyphenyl)-3,3',4,4'-tetrahydro-

Registry Numbers

CAS Registry Number

  • 20315-25-7

FDA UNII

  • 0566J48E7X

System Generated Number

  • 0020315257

Structure Descriptors

InChI

InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26+,27+,28+,29+/m0/s1

InChIKey

XFZJEEAOWLFHDH-UKWJTHFESA-N

Smiles

O[C@H]1Cc2c(O)cc(O)c([C@@H]3[C@@H](O)[C@H](Oc4cc(O)cc(O)c34)c5ccc(O)c(O)c5)c2O[C@@H]1c6ccc(O)c(O)c6