CIS-ISOCHLOROGENIC-ACID

Structure

Drag to rotate, scroll to zoom

3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 162954740

(3R,5R)-3-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-5-(((Z)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4-dihydroxycyclohexane-1-carboxylic acid

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)O

C₂₅H₂₄O₁₂

516.46 g/mol

516.1268 Da

Pathway:

Superclass:

Class:

Glycoside:

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

Plant	Plant part	Amount	Reference
Pyrus communis L. subsp. pyraster (L.) Ehrh.	-	-	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
Pyrus communis L. subsp. pyraster (L.) Ehrh.	-	-	Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.