Procyanidin B1-d3

Product Specifications

Hazard Statement

No Data Available

Smiles

[2H]c1c(O)c([2H])c2O[C@@H]([C@H](O)[C@H](c2c1O)c3c(O)c([2H])c(O)c4C[C@H](O)[C@H](Oc34)c5ccc(O)c(O)c5)c6ccc(O)c(O)c6

Molecular Formula

C30 D3 H23 O12

Molecular Weight

581.539

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/i7D,8D,10D

Additionnal Information

IUPAC name: (2R,3R,4R)-6,8-dideuterio-4-[(2R,3S)-6-deuterio-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol