(Q27145463)

CHEBI:75667 (English)

(2R,3S)-8-[(2R,3S,4S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol

8 October 2016

stereoisomer of

2 references

inferred from InChIKey

(-)-epicatechin-(4beta->8)-(+)-gallocatechin

inferred from InChI

1 reference

(-)-epicatechin-(4beta->8)-(-)-epigallocatechin

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₃₀H₂₆O₁₃

1 reference

CHEBI:75667 (English)

8 October 2016

canonical SMILES

C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O

1 reference

CHEBI:75667 (English)

8 October 2016

isomeric SMILES

C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@H]3[C@@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C(=C6)O)O)O)O

1 reference

Polyphenolic compounds from Croton lechleri

CHEBI:75667 (English)

8 October 2016

1 reference

1 reference

Identifiers

InChI

InChI=1S/C30H26O13/c31-12-6-17(35)23-22(7-12)42-29(10-1-2-14(32)16(34)3-10)27(41)25(23)24-18(36)9-15(33)13-8-21(39)28(43-30(13)24)11-4-19(37)26(40)20(38)5-11/h1-7,9,21,25,27-29,31-41H,8H2/t21-,25+,27+,28-,29-/m1/s1

1 reference

CHEBI:75667 (English)

YJMNEZANCYQLJR-QKFRQTJPSA-N

8 October 2016

InChIKey

2 references

CHEBI:75667 (English)

8 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2R,2'R,3S,3'R,4S)-2-(3,4-Dihydroxyphenyl)-2'-(3,4,5-trihydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-4,8'-bichromene-3,3',5,5',7,7'-hexol (English)

8 October 2016

1 reference

CHEBI:75667 (English)

8 October 2016

Reaxys registry number

4777428

1 reference

(+)-catechin-(4alpha->8)-(-)-epigallocatechin (English)

8 October 2016

ChEBI ID

75667

mapping relation type

2 references

(+)-catechin-(4alpha->8)-(-)-epigallocatechin (English)