3,5-DICAFFEOYL-QUINIC-ACID-METHYL-ESTER

Structure

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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 10075681

(1R,3R)-2,5-dihydroxy-5-(methoxycarbonyl)cyclohexane-1,3-diyl (2E,2'E)-bis(3-(3,4-dihydroxyphenyl)acrylate)

C1C(C[C@H](C([C@@H]1OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)(O)C(=O)OC

C₂₆H₂₆O₁₂

530.48 g/mol

530.1424 Da

Pathway:

Superclass:

Class:

Glycoside:

Chemical classification: NPClassifier (Kim et al., 2021)

Plant	Plant part	Amount	Reference
Erigeron annuus (L.) Desf.	flower	-	Oh, H., Lee, S., Lee, H.S., Lee, D.H., Lee, S.Y., Chung, H.T., Kim, T.S., Kwon, T.O. (2002). Germination inhibitory constituents from Erigeron annuus. Phytochemistry, 61(2), 175-179 doi:10.1016/s0031-9422(02)00236-4
Lonicera japonica Thunb.	flower	25 ppm	Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.

Plant	Plant part	Amount	Reference
Erigeron annuus (L.) Desf.	flower	-	Oh, H., Lee, S., Lee, H.S., Lee, D.H., Lee, S.Y., Chung, H.T., Kim, T.S., Kwon, T.O. (2002). Germination inhibitory constituents from Erigeron annuus. Phytochemistry, 61(2), 175-179 doi:10.1016/s0031-9422(02)00236-4
Lonicera japonica Thunb.	flower	25 ppm	Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.