(-)-dehydrodiconiferyl acid

Chemical Formula:

C₂₀H₁₉O₇

Molecular Weight:

371.366 Daltons

Monoisotopic Mass:

372.12090299669995 Daltons

SMILES:

COC1(=CC(=CC=C(O)1)C2(OC3(=C(C(CO)2)C=C(C=CC([O-])=O)C=C(OC)3)))

InChI:

1S/C20H20O7/c1-25-16-9-12(4-5-15(16)22)19-14(10-21)13-7-11(3-6-18(23)24)8-17(26-2)20(13)27-19/h3-9,14,19,21-22H,10H2,1-2H3,(H,23,24)/p-1/b6-3+/t14-,19+/m1/s1

InChIKey:

FHYQIQMSODIFCP-WARYXCEBSA-M

Synonyms

(-)-DCA-C
(2E)-3-[(2R,3S)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl] acrylate

Databases

MetaCyc: CPD-17077

ChEBI: 131932

PubChem (CID): 38356814

MetaNetX: MNXM147621