(+)-dehydrodiconiferyl acid aldehyde

Chemical Formula:

C₂₀H₁₇O₇

Molecular Weight:

369.35 Daltons

Monoisotopic Mass:

370.1052529325 Daltons

SMILES:

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

InChI:

1S/C20H18O7/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/h3-10,14,19,22H,1-2H3,(H,23,24)/p-1/b6-3+/t14-,19+/m0/s1

InChIKey:

WJCNWNKOLJMKJE-ZMOFONSMSA-M

Synonyms

(+)-DCA-CL
(2E)-3-[(2S,3S)-3-formyl-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoate

Databases

MetaCyc: CPD-18964

ChEBI: 131936

PubChem (CID): 119058218

MetaNetX: MNXM162512