sinapoyltartronate

Chemical Formula:

C₁₄H₁₂O₉

Molecular Weight:

324.243 Daltons

Monoisotopic Mass:

326.0637820483 Daltons

SMILES:

COC1(=CC(C=CC(=O)OC(C(=O)[O-])C(=O)[O-])=CC(OC)=C(O)1)

InChI:

1S/C14H14O9/c1-21-8-5-7(6-9(22-2)11(8)16)3-4-10(15)23-12(13(17)18)14(19)20/h3-6,12,16H,1-2H3,(H,17,18)(H,19,20)/p-2/b4-3+

InChIKey:

BILXTXFCLYPNMR-ONEGZZNKSA-L

Synonyms

Databases

MetaCyc: SINAPOYLTARTRONATE

ChEBI: 57680

PubChem (CID): 25244155

KEGG: C02750

Seed: cpd01780

MetaNetX: MNXM4825