CHEBI:71519 - anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] betaine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] betaine
ChEBI ID CHEBI:71519
ChEBI ASCII Name anthocyanidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside] betaine
Definition An oxonium betaine arising from regioselective deprotonation of the 5-hydroxy group of any anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] (R groups may be H).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Download Molfile XML SDF
Formula C36H34O16R2
Net Charge 0
Average Mass (excl. R groups) 722.647
Monoisotopic Mass (excl. R groups) 722.18469
SMILES C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c([O-])cc(O)cc4[o+]c3-c3cc([*])c(O)c([*])c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1OC(=O)C=Cc1ccc(O)cc1
ChEBI Ontology
Outgoing anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] betaine (CHEBI:71519) is a oxonium betaine (CHEBI:51978)
anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] betaine (CHEBI:71519) is conjugate base of anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] (CHEBI:71592)
Incoming anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] (CHEBI:71592) is conjugate acid of anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] betaine (CHEBI:71519)
Synonyms Sources
an anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] UniProt
anthocyanidin 3-O-[2-O-(4-coumaroyl)-α-L-rhamnosyl-(1→6)-β-D-glucoside] betaines ChEBI
Manual Xref Database
Anthocyanidin-coum-rham-D-glucosides MetaCyc
View more database links
Last Modified
04 December 2019