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CHEBI:70204 - 2''-O-rhamnosylscoparin

ChEBI IDCHEBI:70204
ChEBI Name2''-O-rhamnosylscoparin
Stars
ASCII Name2''-O-rhamnosylscoparin
DefinitionA flavone C-glycoside that is 5,7,4'-trihydroxy-3'-methoxyflavone substituted by a 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl residue at position 8. It has been isolated from the leaves and roots of Petrorhagia velutina.
Last Modified14 October 2014
DownloadsMolfile
FormulaC28H32O15
Net Charge0
Average Mass608.549
Monoisotopic Mass608.17412
SMILES[H][C@@]1(O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)c(OC)c4)oc23)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C28H32O15/c1-9-20(34)22(36)24(38)28(40-9)43-27-23(37)21(35)17(8-29)42-26(27)19-13(32)6-12(31)18-14(33)7-15(41-25(18)19)10-3-4-11(30)16(5-10)39-2/h3-7,9,17,20-24,26-32,34-38H,8H2,1-2H3/t9-,17+,20-,21+,22+,23-,24+,26-,27+,28-/m0/s1
InChIKeyUBWXCUKKZPNFTJ-VVVHOGNVSA-N
Species of MetaboliteComponentSourceComments
Petrorhagia velutina (ncbitaxon:308175)
leaf (BTO:0000713) PubMed (21080643) Methanolic extract of dried leaf and root
root (BTO:0001188) PubMed (21080643) Methanolic extract of dried leaf and root
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
2''-O-rhamnosylscoparin (CHEBI:70204) has role plant metabolite (CHEBI:76924)
2''-O-rhamnosylscoparin (CHEBI:70204) is a disaccharide derivative (CHEBI:63353)
2''-O-rhamnosylscoparin (CHEBI:70204) is a flavone C-glycoside (CHEBI:83280)
2''-O-rhamnosylscoparin (CHEBI:70204) is a monomethoxyflavone (CHEBI:25401)
2''-O-rhamnosylscoparin (CHEBI:70204) is a trihydroxyflavone (CHEBI:27116)
IUPAC Name 
(1S)-1,5-anhydro-2-O-(6-deoxy-α-L-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol
Citations