luteolin 7-O-neohesperidoside (CHEBI:31788)

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:31788 - luteolin 7-O-neohesperidoside

ChEBI ID	CHEBI:31788
ChEBI Name	luteolin 7-O-neohesperidoside
Stars
ASCII Name	luteolin 7-O-neohesperidoside
Definition	A disaccharide derivative that is luteolin substituted by a 2-O-(α-L-rhamnopyranosyl)-β-D-glucopyranosyl moiety at position 7 via a glycosidic linkage.
Last Modified	28 July 2015
Downloads	Molfile

Formula	C27H30O15
Net Charge	0
Average Mass	594.522
Monoisotopic Mass	594.15847
SMILES	C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
InChI	InChI=1S/C27H30O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-7,9,18,20-31,33-37H,8H2,1H3/t9-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
InChIKey	SHPPXMGVUDNKLV-KMFFXDMSSA-N

Roles Classification

Biological Roles:

antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria.

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology

Outgoing Relation(s)
	luteolin 7-O-neohesperidoside (CHEBI:31788) has functional parent luteolin (CHEBI:15864)
	luteolin 7-O-neohesperidoside (CHEBI:31788) has role antibacterial agent (CHEBI:33282)
	luteolin 7-O-neohesperidoside (CHEBI:31788) has role metabolite (CHEBI:25212)
	luteolin 7-O-neohesperidoside (CHEBI:31788) is a disaccharide derivative (CHEBI:63353)
	luteolin 7-O-neohesperidoside (CHEBI:31788) is a glycosyloxyflavone (CHEBI:50018)
	luteolin 7-O-neohesperidoside (CHEBI:31788) is a neohesperidoside (CHEBI:25495)
	luteolin 7-O-neohesperidoside (CHEBI:31788) is a trihydroxyflavone (CHEBI:27116)

IUPAC Name
2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl 2-O-(α-L-rhamnopyranosyl)-β-D-glucopyranoside

Synonyms	Source
Luteolin 7-O-neohesperidoside	KEGG COMPOUND
Scolymoside	KEGG COMPOUND
Veronicastroside	KEGG COMPOUND
Lonicerin	ChemIDplus
Luteolin-7-O-rhamnoside	ChemIDplus
Luteolin-7-rutinoside	ChemIDplus

Manual Xrefs	Databases
C12630	KEGG COMPOUND
LUTEOLIN-7-O-NEOHESPERIDOSIDE	MetaCyc
HMDB0005799	HMDB
KR20050005633	Patent
C00004283	KNApSAcK

Registry Numbers	Sources
Reaxys:1361176	Reaxys
CAS:25694-72-8	KEGG COMPOUND
CAS:25694-72-8	ChemIDplus

Citations