CHEBI:5196 - furcatin

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ChEBI Name furcatin
ChEBI ID CHEBI:5196
Definition A disaccharide derivative that is β-D-apiofuranosyl-(1→6)-D-glucopyranose with a 4-(prop-2-en-1-yl)phenyl group substituent.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H28O10
Net Charge 0
Average Mass 428.43030
Monoisotopic Mass 428.16825
InChI 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
SMILES OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@@H](Oc3ccc(CC=C)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing furcatin (CHEBI:5196) has functional parent β-D-apiofuranosyl-(1→6)-D-glucopyranose (CHEBI:55406)
furcatin (CHEBI:5196) has role metabolite (CHEBI:25212)
furcatin (CHEBI:5196) is a disaccharide derivative (CHEBI:63353)
IUPAC Name
4-(prop-2-en-1-yl)phenyl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]-β-D-glucopyranoside
Synonym Source
β-D-apiofuranosyl-(1→6)-D-glucopyranosyl-4-(prop-2-en-1-yl)phenyl ChEBI
Manual Xrefs Databases
C00002745 KNApSAcK
C10458 KEGG COMPOUND
CPD-14703 MetaCyc
View more database links
Registry Numbers Types Sources
499-33-2 CAS Registry Number KEGG COMPOUND
6444066 Reaxys Registry Number Reaxys
Last Modified
28 July 2014