furcatin

Chemical Formula:

C₂₀H₂₈O₁₀

Molecular Weight:

428.435 Daltons

Monoisotopic Mass:

428.16824711979996 Daltons

SMILES:

C=CCC3(C=CC(OC2(OC(COC1(OCC(O)(CO)C(O)1))C(O)C(O)C(O)2))=CC=3)

InChI:

1S/C20H28O10/c1-2-3-11-4-6-12(7-5-11)29-18-16(24)15(23)14(22)13(30-18)8-27-19-17(25)20(26,9-21)10-28-19/h2,4-7,13-19,21-26H,1,3,8-10H2/t13-,14-,15+,16-,17+,18-,19-,20-/m1/s1

InChIKey:

HLTAEJNADMCLOV-LTRJMQNCSA-N

Synonyms

(2R,3S,4S,5R,6S)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-(4-prop-2-enylphenoxy)oxane-3,4,5-triol
p-allylphenyl 6-O-β-D-apiofuranosyl-β-D-glucopyranoside

Databases

MetaCyc: CPD-14703

RefMet: Furcatin

MetaboLights: MTBLC5196

ChEBI: 5196

ChemSpider: 391122

KEGG: C10458

PubChem (CID): 442789

Seed: cpd07344

MetaNetX: MNXM54036