Project Description

PRODUCT SPECIFICATIONS

PRODUCT

(-)-Epicatechingallate

CAS #

1257-08-5

SYNONYM BENZOIC ACID, 3,4,5-TRIHYDROXY-, 2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-5,7-DIHYDROXY-2H-1-BENZOPYRAN-3-YL ESTER, (2R-CIS)-; (-)-EPICATECHIN GALLATE; EPICATECHIN GALLATE; EPICATECHIN GALLATE, (-)-; (-)-ECG; (-)-CIS-3,3′,4′,5,7-PENTAHYDROXYFLAVANE 3-GALLATE; (-)-CIS-2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-1(2H)-BENZOPYRAN-3,5,7-TRIOL 3-GALLATE; (2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-1(2H)-BENZOPYRAN-3,5,7-TRIOL 3-(3,4,5-TRIHYDROXYBENZOATE);(-)-Epicatechin gallate;

  • (-)-Epicatechin-3-gallate;
  • (-)-Epicatechin-3-O-gallate;
  • epi-Catechin 3-O-gallate;
  • Epicatechol, gallate (6CI);
  • L-Epicatechin gallate;
  • NSC 636594;
  • UNII-92587OVD8Z;

Systematic Names

  • Benzoic acid, 3,4,5-trihydroxy-, (2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester;
  • Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-cis)-;
  • Epicatechol, 3-gallate, (-)- (8CI);
FORMULA

C22H18O10;

MOLECULAR WEIGHT

442.37

SMILES

c1c(c(ccc1[C@@H]1[C@H](OC(=O)c2cc(c(c(c2)O)O)O)Cc2c(cc(O)cc2O1)O)O)O

INCHI

LSHVYAFMTMFKBA-TZIWHRDSSA-N

INCHIKEY

1S/C22H18O10/c23-11-6-14(25)12-8-19(32-22(30)10-4-16(27)20(29)17(28)5-10)21(31-18(12)7-11)9-1-2-13(24)15(26)3-9/h1-7,19,21,23-29H,8H2/t19-,21-/m1/s1

STORAGE TEMPERATURE

2-8°C

WATER SOLUBILITY

Soluble in water, acetone, DMSO, methanol.

MELTING POINT

257-258°C

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