CHEBI:77945 - anthocyanidin 3-O-β-D-sambubioside betaine

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ChEBI Name anthocyanidin 3-O-β-D-sambubioside betaine ChEBI ID CHEBI:77945 ChEBI ASCII Name anthocyanidin 3-O-beta-D-sambubioside betaine Definition An oxonium betaine obtained by deprotonation of the 5-hydroxy group of any anthocyanidin 3-O-β-D-sambubioside. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C26H26O14R2 Net Charge 0 Average Mass (excl. R groups) 562.477 Monoisotopic Mass (excl. R groups) 562.13226 SMILES OC[C@H]1O[C@@H](Oc2cc3c([O-])cc(O)cc3[o+]c2-c2cc([*])c(O)c([*])c2)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O ChEBI Ontology Outgoing anthocyanidin 3-O-β-D-sambubioside betaine (CHEBI:77945) is a oxonium betaine (CHEBI:51978) anthocyanidin 3-O-β-D-sambubioside betaine (CHEBI:77945) is conjugate base of anthocyanidin 3-O-β-D-sambubioside (CHEBI:71506) Incoming anthocyanidin 3-O-β-D-sambubioside (CHEBI:71506) is conjugate acid of anthocyanidin 3-O-β-D-sambubioside betaine (CHEBI:77945) Synonym Source an anthocyanidin 3-O-β-D-sambubioside UniProt Last Modified 10 June 2014