CHEBI:70204 - 2''-O-rhamnosylscoparin

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ChEBI Name 2''-O-rhamnosylscoparin
ChEBI ID CHEBI:70204
ChEBI ASCII Name 2''-O-rhamnosylscoparin
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C28H32O15
Net Charge 0
Average Mass 608.54470
Monoisotopic Mass 608.17412
InChI InChI=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
InChIKey UBWXCUKKZPNFTJ-VVVHOGNVSA-N
SMILES COc1cc(ccc1O)-c1cc(=O)c2c(O)cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)c2o1
Metabolite of Species Details
Petrorhagia velutina (NCBI:txid308175) Found in root (BTO:0001188). Methanolic extract of dried leaf and root See: PubMed
Petrorhagia velutina (NCBI:txid308175) Found in leaf (BTO:0000713). Methanolic extract of dried leaf and root See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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
Citation Waiting for Citations Type Source
21080643 PubMed citation Europe PMC
Last Modified
14 October 2014