CHEBI:28596 - isoorientin 2''-O-rhamnoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name isoorientin 2''-O-rhamnoside
ChEBI ID CHEBI:28596
ChEBI ASCII Name isoorientin 2''-O-rhamnoside
Definition A tetrahydroxyflavone that consists of isoorientin substituted by a rhamnosyl moiety at position 2".
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:6035, CHEBI:24906
Supplier Information
Download Molfile XML SDF
Formula C27H30O16
Net Charge 0
Average Mass 594.51810
Monoisotopic Mass 594.15847
InChI InChI=1S/C27H30O15/c1-8-19(33)22(36)24(38)27(39-8)42-26-23(37)20(34)16(7-28)41-25(26)18-13(32)6-15-17(21(18)35)12(31)5-14(40-15)9-2-3-10(29)11(30)4-9/h2-6,8,16,19-20,22-30,32-38H,7H2,1H3/t8-,16+,19-,20+,22+,23-,24+,25-,26+,27?/m0/s1
InChIKey IUYFTHKQEWZTHY-LQQQXCKLSA-N
SMILES C[C@@H]1OC(O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c2c(O)cc3oc(cc(=O)c3c2O)-c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
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.
Application(s): antifeedant
A substance that prevents pests from feeding.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing isoorientin 2''-O-rhamnoside (CHEBI:28596) has functional parent isoorientin (CHEBI:17965)
isoorientin 2''-O-rhamnoside (CHEBI:28596) has role antifeedant (CHEBI:22583)
isoorientin 2''-O-rhamnoside (CHEBI:28596) has role plant metabolite (CHEBI:76924)
isoorientin 2''-O-rhamnoside (CHEBI:28596) is a flavone C-glycoside (CHEBI:83280)
isoorientin 2''-O-rhamnoside (CHEBI:28596) is a tetrahydroxyflavone (CHEBI:38684)
Incoming 2''-O-α-L-rhamnosylisoorietin (CHEBI:70203) is a isoorientin 2''-O-rhamnoside (CHEBI:28596)
IUPAC Name
(1S)-1,5-anhydro-2-O-(6-deoxy-L-mannopyranosyl)-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-D-glucitol
Synonyms Sources
Isoorientin 2''-O-rhamnoside KEGG COMPOUND
rhamnosylisoorientin ChEBI
Manual Xrefs Databases
C00006208 KNApSAcK
C03870 KEGG COMPOUND
CPD-9587 MetaCyc
LMPK12110495 LIPID MAPS
View more database links
Registry Number Type Source
8028926 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
1484895 PubMed citation Europe PMC
15796587 PubMed citation Europe PMC
19040117 PubMed citation Europe PMC
22171285 PubMed citation Europe PMC
Last Modified
14 October 2014