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Chlorogenic acid

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Chlorogenic acid

Chlorogenic acid

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CAT	APS327979
CAS	327-97-9
Structure
MDL Number	MFCD00003862
Synonyms	Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, [1S-(1α,3β,4α,5α)]-, 3-O-Caffeoylquinic acid, Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, (1S,3R,4R,5R)- (9CI), 3-(3,4-Dihydroxycinnamoyl)quinic acid, 3-O-(3,4-Dihydroxycinnamoyl)-D-quinic acid,(1S,3R,4R,5R)-3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-Cyclohexanecarboxylic acid, NSC 407296, Chlorogenic acid (8CI), 3-Caffeoylquinic acid, Heriguard, NSC 70861
IUPAC Name	(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
Molecular Weight	354.31
Molecular Formula	C16H18O9
EC Number	206-325-6
Canonical SMILES	O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(=O)O
InChI	InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1
InChI Key	CWVRJTMFETXNAD-JUHZACGLSA-N

Description	United States Pharmacopeia (USP) Reference Standard, primary reference standard
Accurate Mass	354.0951
Format	Neat
Grade	primary reference standard
MP	210 °C (dec.) (lit.)
Size	25MG, 50MG

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CAT	Size	Shipping	Storage Conditions	Description	Price
APS327979-100MG	100MG	Room Temperature	+4°C	Subcategory: Nutritional composition compounds	Inquiry
APS327979-25MG	25MG	Room Temperature	2-8°C Fridge/Coldroom	API Family: Matrix - API Family See respective official monograph(s); Product Type: API; Subcategory: European Pharmacopoeia (Ph. Eur.)	Inquiry

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