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(±)-Gallocatechin-2,3,4-[13C3] gallate

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General Information
Catalog: BLP-005534
Molecular Formula: [13C]3C19H18O11
Molecular Weight: 461.35

Chemical Structure

Description	(±)-Gallocatechin-2,3,4-[13C3] gallate is an isotopical edition of (±)-Gallocatechin gallate. Gallocatechin gallate is the ester of gallocatechin and gallic acid and a type of catechin. And it is a polyphenol compound found in green tea with anticancer activities.
Synonyms	[(2R,3S)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
Related CAS	5127-64-0 (unlabelled)
Canonical SMILES	C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
InChI	InChI=1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21+/m0/s1/i7+1,18+1,21+1
InChI Key	PBNRGPHPGVOJMG-XKYSQPNFSA-N
Purity	≥97% by CP; ≥99% atom 13C
Appearance	Solid