| Identification | Back Directory | [Name]
Neochlorogenic acid | [CAS]
906-33-2 | [Synonyms]
Neochlorogenate
Einecs 212-997-1
Neochlorogenic aci
Nochlorogenic acid
Neochlorogenic acid
5-Caffeoylquinic acid
5-O-CAFFEOYLQUINICACID
5-Dicaffeoylquinic Acid
Neochlorogenic acid(3')
(E)-Neochlorogenic Acid
trans-5-O-Caffeoyl-D-quinate
trans-5-O-Caffeoylquinic acid
Neochlorogenic acid USP/EP/BP
trans-5-O-caffeoyl-D-quinic acid
NEOCHLOROGENIC ACID FROM LONICERA J
NEOCHLOROGENIC ACID FROM LONICERA JA
5-Caffeoylquinic acid/Neochlorogenic acid
Neochlorogenic acid
5-Caffeoylquinic acid
Cryptochlorogenic acid
5-Caffeoylquinic acid
5-O-(trans-3,4-Dihydroxycinnamoyl)-D-quinic acid
Neochlorogenic acid (trans-5-O-Caffeoylquinic acid)
Neochlorogenic acid，5-Caffeoylquinic acid，trans-5-O-Caffeoyl-D-quinate
3-{[3-(3,4-Dihydroxyphenyl)acryloyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylic acid
5α-[3-(3,4-Dihydroxyphenyl)acryloyloxy]-1,3β,4α-trihydroxycyclohexane-1β-carboxylic acid
1,3β,4α-Trihydroxy-5α-[3-(3,4-dihydroxyphenyl)acryloyloxy]cyclohexane-1β-carboxylic acid
1,3β,4α-Trihydroxy-5α-[3-(3,4-dihydroxyphenyl)propenoyloxy]cyclohexane-1β-carboxylic acid
3β-[3-(3,4-Dihydroxyphenyl)propenoyloxy]-1,4β,5α-trihydroxycyclohexane-1α-carboxylic acid
5β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1α,3α,4α-trihydroxycyclohexanecarboxylic acid
[1R-(1α,3α,4α,5β)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid
(1R)-1α,3α,4α-Trihydroxy-5β-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β-cyclohexanecarboxylic acid
(1R)-3β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β,4β,5α-trihydroxycyclohexane-1α-carboxylic acid
(1R,3R,4S,5R)-5-[(E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-1,3,4-trihydroxycyclohexane-1-carboxylic acid
Cyclohexanecarboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-, (1R,3R,4S,5R)-
(1R-(1alpha,3alpha,4alpha,5beta))-3-((3-(3,4-Dihydroxyphenyl)-1-oxoallyl)oxy)-1,4,5-trihydroxycyclohexanecarboxylic acid
[1R-(1alpha,3alpha,4alpha,5beta)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid
Cyclohexanecarboxylic acid, 3-((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-1,4,5-trihydroxy-, (1R-(1alpha,3alpha,4alpha,5beta))- | [EINECS(EC#)]
212-997-1 | [Molecular Formula]
C16H18O9 | [MDL Number]
MFCD10566639 | [MOL File]
906-33-2.mol | [Molecular Weight]
354.309 |
| Chemical Properties | Back Directory | [Melting point ]
204-206 °C (decomp) | [Boiling point ]
665.0±55.0 °C(Predicted) | [density ]
1.65±0.1 g/cm3(Predicted) | [storage temp. ]
2-8°C | [solubility ]
DMSO (Slightly), Ethanol (Slightly, Heated, Sonicated) | [form ]
neat | [pka]
3.90±0.50(Predicted) | [color ]
White to Off-White | [biological source]
Lonicera japonica | [Stability:]
Hygroscopic | [InChIKey]
CWVRJTMFETXNAD-NXLLHMKUSA-N | [SMILES]
[C@@]1(O)(C(O)=O)C[C@@H](O)[C@H](O)[C@H](OC(=O)/C=C/C2=CC=C(O)C(O)=C2)C1 | [LogP]
0.370 (est) | [CAS DataBase Reference]
906-33-2 |
| Hazard Information | Back Directory | [Chemical Properties]
Soluble in hot water, ethanol and acetone, completely soluble. Very slightly soluble in ethyl acetate. Derived from honeysuckle | [Uses]
(E)-Neochlorogenic Acid is an antioxidant compound used in the treatment of oxidative stress and related afflictions. | [Definition]
ChEBI: A cinnamate ester obtained by formal condensation of the carboxy group of trans-caffeic acid with the 5-hydroxy group of quinic acid. | [General Description]
This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG | [Biochem/physiol Actions]
Neochlorogenic acid has been found to have an inhibitory effect on the biosynthesis of melanin. Therefore it can be used on harvested fruits to prevent brown rot infection caused by?Monilinia laxa. It also shows impressive antioxidant, antibacterial, antiviral and antipyretic characteristics. Neochlorogenic acid has the potential to be used in the management of acute and chronic inflammatory diseases due to its anti-inflammatory activity. It may function as chemopreventive compounds due to growth inhibition seen in breast cancer cell line MDA-MB-435. | [IC 50]
p65; IL-1β; COX-2 |
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