(Q7247558)

Procyanidin B6 (English)

2alpha,2'alpha-Bis(3,4-dihydroxyphenyl)-3,3',4,4'-tetrahydro-4alpha,6'-bi[2H-1-benzopyran]-3alpha,3'beta,5,5',7,7'-hexaol

8 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(2R,3R)-2-(3,4-dihydroxyphenyl)-6-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol

1 reference

1 reference

(4R)-2beta,2'beta-Bis(3,4-dihydroxyphenyl)-3,3',4,4'-tetrahydro-4,6'-bi[2H-1-benzopyran]-3beta,3'beta,5,5',7,7'-hexol

1 reference

1 reference

(2R,3R)-2-(3,4-dihydroxyphenyl)-6-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₂₆O₁₂

1 reference

Procyanidin B6 (English)

8 October 2016

canonical SMILES

C1C(C(OC2=CC(=C(C(=C21)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O

1 reference

Procyanidin B6 (English)

8 October 2016

isomeric SMILES

C1[C@@H]([C@H](OC2=CC(=C(C(=C21)O)[C@H]3[C@@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O

1 reference

Flavan-3-ol and procyanidin glycosides from quercus miyagii

Procyanidin B6 (English)

8 October 2016

1 reference

Salix sieboldiana

1 reference

Acylated flavanols and procyanidins from Salix sieboldiana

Nelumbo nucifera

1 reference

Isolation, characterization, and determination of antioxidative activity of oligomeric procyanidins from the seedpod of Nelumbo nucifera Gaertn

Identifiers

InChI

InChI=1S/C30H26O12/c31-13-7-19(36)24-23(8-13)42-30(12-2-4-16(33)18(35)6-12)28(40)26(24)25-20(37)10-22-14(27(25)39)9-21(38)29(41-22)11-1-3-15(32)17(34)5-11/h1-8,10,21,26,28-40H,9H2/t21-,26-,28-,29+,30+/m0/s1

1 reference

Procyanidin B6 (English)

8 October 2016

2 references

Procyanidin B6 (English)

8 October 2016

ChEBI release 2020-09-01

CAS Registry Number

12798-58-2

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

Procyanidin B6 (English)

8 October 2016

2 references

Procyanidin B6 (English)

8 October 2016

Reaxys registry number

3586527

1 reference

procyanidin B6 (English)

8 October 2016

ChEBI ID

75619

mapping relation type

2 references

procyanidin B6 (English)

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C30H26O12/c31-13-7-19(36)24-23(8-13)42-30(12-2-4-16(33)18(35)6-12)28(40)26(24)25-20(37)10-22-14(27(25)39)9-21(38)29(41-22)11-1-3-15(32)17(34)5-11/h1-8,10,21,26,28-40H,9H2/t21-,26-,28-,29+,30+/m0/s1

1 reference

CHEMBL502984 (English)

8 October 2016

1 reference

1 reference

Human Metabolome Database ID

HMDB0038367

0 references

UNII

SZ77QV8UB3

1 reference