(1α,3R,4α,5R)-1-((3-(3,4-Dihydroxyphenyl)acryloyl)oxy)-3,4,5-trihydroxycyclohexane-1-carboxylic acid, 98%

cas: 1241-87-8 — see every product listed under this CAS number, including other names

(1α,3R,4α,5R)-1-((3-(3,4-Dihydroxyphenyl)acryloyl)oxy)-3,4,5-trihydroxycyclohexane-1-carboxylic acid, 98% (CAS 1241-87-8) is a chemical reagent available from Chemat. Available pack sizes: 1mg. Offered by: Chemat.

brandChemat
catalog numberCh111LL5-1mg
cas1241-87-8
size1mg
availability 0.009g
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Available pack sizes

brand size price
Chemat 1mg 966.80 Pln

properties

purity98%
delivery time3 weeks
Structural formula: {0} (CAS {1})

1-O-caffeoylquinic acid is an alkyl caffeate ester obtained by the formal condensation of the carboxy group of trans-caffeic acid with the 1-hydroxy group of ()-quinic acid. It has a role as a Camellia sinensis metabolite, an antioxidant, an antineoplastic agent and a NF-kappaB inhibitor. It is a quinic acid and an alkyl caffeate ester. It is functionally related to a trans-caffeic acid. It derives from a hydride of a (-)-quinic acid.

Source: ChEBI

Identity
Molecular formulaC16H18O9
Molecular weight354.31 g/mol
IUPAC nametrans-(3R,5R)-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4,5-trihydroxycyclohexane-1-carboxylic acid
InChIKeyGWTUHAXUUFROTF-AVXJPILUSA-N
SMILESC1[C@H](C([C@@H](CC1(C(=O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O)O

Computed by PubChem (NCBI)

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