123483-19-2
123483-19-2
Chemical Structure
3-O-Caffeoylquinic acid methyl ester
- CAS No.: 123483-19-2
- Formula:C17H20O9
- Molecular Weight:368.34
IUPAC Name: methyl (1S,3R,4R,5R)-3-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4,5-trihydroxycyclohexane-1-carboxylate
InChIKey: MZNIJRAPCCELQX-AWOKGZDASA-N
SMILES: O=C([C@@]1(O)C[C@@H](OC(/C=C/C2=CC=C(O)C(O)=C2)=O)[C@H](O)[C@H](O)C1)OC
Biological Activity: 3-O-Caffeoylquinic acid methyl ester is a monocaffeoylquinic acid derivative and phenolic acid component, which can be found in the whole plant of Pyrrosia calvata (Backer) Ching and the flower buds of Lonicera japonica Thunb[1][2].
| Cat. No. | Product Name | Purity | Description | Pricing | |||||||||||||||||||
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3-O-Caffeoylquinic acid methyl ester | 99.46% | 3-O-Caffeoylquinic acid methyl ester is a monocaffeoylquinic acid derivative and phenolic acid component, which can be found in the whole plant of Pyrrosia calvata (Backer) Ching and the flower buds of Lonicera japonica Thunb. | ||||||||||||||||||||
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Structural Analogs
-
Similarity Score 1.00
HY-N4168ANeochlorogenic acid methyl ester -
Similarity Score 1.00
HY-N4168BMethyl chlorogenate -
Similarity Score 0.91
HY-N9729Ethyl chlorogenate -
Similarity Score 0.89
HY-N0055Atrans-Chlorogenic acid -
Similarity Score 0.89
HY-N0055RChlorogenic acid (Standard) -
Similarity Score 0.89
HY-N0722A(Z)-Neochlorogenic acid -
Similarity Score 0.89
HY-N0722RNeochlorogenic acid (Standard) -
Similarity Score 0.87
HY-N8604Methyl 4-O-caffeoylquinate -
Similarity Score 0.87
HY-N10016Chlorogenic acid butyl ester -
Explore the MedChemAI to find more analogs
References
- [1]. Chen YJ, et al. Chemical Constituents of Pyrrosia calvata. Nat Prod Commun. 2015;10(7):1191-1193. [Content Brief]
- [2]. Ge L, et al. Novel caffeoylquinic acid derivatives from Lonicera japonica Thunb. flower buds exert pronounced anti-HBV activities. RSC Adv. 2018 Oct 15;8(62):35374-35385. [Content Brief]
