Chemical Compound

Cinnamtannin A3

CAS Registry Number 86631-39-2
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Cinnamtannin A3 chemical structure
Primary Record

Cinnamtannin A3

In stock
3,811 g
Purity
99.3 %
CAS
86631-39-2

Compound Identifiers & Properties

CAS
86631-39-2
PubChem CID
16129741
SMILES
C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@@H]3[C@H]([C@H](OC4=C3C(=CC(=C4[C@@H]5[C@H]([C@H](OC6=C(C(=CC(=C56)O)O)[C@@H]7[C@H]([C@H](OC8=C(C(=CC(=C78)O)O)[C@@H]9[C@H]([C@H](OC1=CC(=CC(=C91)O)O)C1=CC(=C(C=C1)O)O)O)C1=CC(=C(C=C1)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O
Canonical SMILES
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2

Names & Synonyms

  • Cinnamtannin A3
  • Cinnamtannin II
  • Procyanidin A3
  • ProcyanidinA3
  • Procyanidin E-1
  • RefChem:126265
  • Pentameric proanthocyanidin
  • CHEMBL592373
  • DTXSID70904147
  • SCHEMBL6862310
  • SCHEMBL30538702
  • CHEBI:81228
  • [Epicatechin(4b->8)]4-epicatechin
  • DTXCID601332032
  • 86631-39-2
  • (Epicatechin(4b->8))4-epicatechin
  • BDBM50310256
  • [Epicatechin-(4beta->8)]4-epicatechin
  • J1.803.964H
  • C17626
  • (2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-8-[(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
  • Q23048736
  • (2R,3R,4R)-2-(3,4-dihydroxyphenyl)-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-yl]-4-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
  • [4,8':4',8'':4'',8''':4''',8''''-Quinque-2H-1-benzopyran]-3,3',3'',3''',3'''',5,5',5'',5''',5'''',7,7',7'',7''',7''''-pentadecol, 2,2',2'',2''',2''''-pentakis(3,4-dihydroxyphenyl)-3,3',3'',3''',3'''',4,4',4'',4''',4''''-decahydro-, (2R,2'R,2''R,2'''R,2''''R,3R,3'R,3''R,3'''R,3''''R,4R,4'R,4''R,4'''S)-
  • (1~2~R,1~3~R,1~4~R,2~2~R,2~3~R,2~4~R,3~2~R,3~3~R,3~4~R,4~2~R,4~3~R,4~4~S,5~2~R,5~3~R)-1~2~,2~2~,3~2~,4~2~,5~2~-Pentakis(3,4-dihydroxyphenyl)-1~3~,1~4~,2~3~,2~4~,3~3~,3~4~,4~3~,4~4~,5~3~,5~4~-decahydro-1~2~H,2~2~H,3~2~H,4~2~H,5~2~H-[1~4~,2~8~:2~4~,3~8~:3~4~,4~8~:4~4~,5~8~-quinque-1-benzopyran]-1~3~,1~5~,1~7~,2~3~,2~5~,2~7~,3~3~,3~5~,3~7~,4~3~,4~5~,4~7~,5~3~,5~5~,5~7~-pentadecol
  • (2R)-2alpha-(3,4-Dihydroxyphenyl)-4beta-[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-4beta-[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxychroman-8-yl]chroman-8-yl]-8-[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-8-[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxychroman-4beta-yl]chroman-4beta-yl]chroman-3alpha,5,7-triol
  • (2R)-3,4-Dihydro-2alpha-(3,4-dihydroxyphenyl)-8-[[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-8-[[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-8-[[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-8-[[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran]-4beta-yl]3,4-dihydro-2H-1-benzopyran]-4beta-yl]-3,4-dihydro-2H-1-benzopyran]-4beta-yl]-3,4-dihydro-2H-1-benzopyran]-4beta-yl]-2H-1-benzopyran-3alpha,5,7-triol
  • (2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-((2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-((2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-((2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl)-8-((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
  • (2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chroman-8-yl]-3,5,7-trihydroxy-chroman-8-yl]-3,5,7-trihydroxy-chroman-8-yl]-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chroman-4-yl]chromane-3,5,7-triol
  • (2R,3R,4R)-2-(3,4-dihydroxyphenyl)-8-((2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-yl)-4-((2R,3R,4R)-2-(3,4-dihydroxyphenyl)-4-((2R,3R,4S)-2-(3,4-dihydroxyphenyl)-4-((2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-8-yl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
  • (2R,3R,4S)-2-(3,4-DIHYDROXYPHENYL)-4-[(2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-3,4-DIHYDRO-2H-1-BENZOPYRAN-8-YL]-8-[(2R,3R,4R)-2-(3,4-DIHYDROXYPHENYL)-8-[(2R,3R,4R)-2-(3,4-DIHYDROXYPHENYL)-8-[(2R,3R,4R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-YL]-3,5,7-TRIHYDROXY-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-YL]-3,5,7-TRIHYDROXY-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-YL]-3,4-DIHYDRO-2H-1-BENZOPYRAN-3,5,7-TRIOL
  • (4beta,4 beta,4 beta,4 beta)-3,3 ,3 ,3 ,3 ,4,4 ,4 ,4 ,4 -Decahydro-2alpha,2 alpha,2 alpha,2 alpha,2 alpha-pentakis(3,4-dihydroxyphenyl)-4,8 :4 ,8 :4 ,8 :4 ,8 -quinque[2H-1-benzopyran]-3alpha,3 alpha,3 alpha,3 alpha,3 alpha,5,5 ,5 ,5 ,5 ,7,7 ,7 ,7 ,7 -pentadecaol
  • 2alpha,2 alpha,2 alpha,2 alpha,2 alpha-Pentakis(3,4-dihydroxyphenyl)-3,3 ,3 ,3 ,3 ,4,4 ,4 ,4 ,4 -decahydro-4beta,8 :4 beta,8 :4 beta,8 :4 beta,8 -quinque[2H-1-benzopyran]-3alpha,3 alpha,3 alpha,3 alpha,3 alpha,5,5 ,5 ,5 ,5 ,7,7 ,7 ,7 ,7 -pentadecaol
  • 4,8':4',8'':4'',8''':4''',8''''-Quinque-2H-1-benzopyran]-3,3',3'',3''',3'''',5,5',5'',5''',5'''',7,7',7'',7''',7''''-pentadecol, 2,2',2'',2''',2''''-pentakis(3,4-dihydroxyphenyl)-3,3',3'',3''',3'''',4,4',4'',4''',4''''-decahydro-, (2R,2'R,2''R,2'''R,2''''R,3R,3'R,3''R,3'''R,3''''R,4R,4'S,4''S,4'''S)-
  • 4beta,8 -[[(2R)-2alpha-(3,4-Dihydroxyphenyl)-3alpha,5,7-trihydroxy-2,3-dihydro-4H-1-benzopyran-8,4beta-diyl][(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-2,3-dihydro-4H-1-benzopyran-8,4beta-diyl][(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-2,3-dihydro-4H-1-benzopyran-8,4beta-diyl]]bis[(2R)-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-2,3-dihydro-4H-1-benzopyran]
  • 4beta,8 :4 beta,8 :4 beta,8 :4 beta,8 -Quinque[(2R)-3,4-dihydro-2alpha-(3,4-dihydroxyphenyl)-3alpha,5,7-trihydroxy-2H-1-benzopyran]
  • 4beta,8 :4 beta,8 :4 beta,8 :4 beta,8 -Quinque[(2R)-3alpha,5,7-trihydroxy-2alpha-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran]
  • epicatechin-(4beta-8)-epicatechin-(4beta-8)-epicatechin-(4beta-8)-epicatechin-(4beta-8)-epicatechin