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CHEBI:63289 - 3-O-(α-L-oleandrosyl)erythronolide B

ChEBI IDCHEBI:63289
ChEBI Name3-O-(α-L-oleandrosyl)erythronolide B
Stars
ASCII Name3-O-(alpha-L-oleandrosyl)erythronolide B
DefinitionA macrolide that is erythronolide B having a 2,6-dideoxy-3-O-methyl-α-Larabino-hexopyranosyl (α-L-oleandrosyl) residue attached at position 3.
Last Modified6 August 2014
SubmitterSteve
DownloadsMolfile
FormulaC28H50O10
Net Charge0
Average Mass546.698
Monoisotopic Mass546.34040
SMILESCC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@H](OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@H]1C
InChIInChI=1S/C28H50O10/c1-10-19-14(3)23(30)15(4)22(29)13(2)12-28(8,34)26(32)16(5)25(17(6)27(33)37-19)38-21-11-20(35-9)24(31)18(7)36-21/h13-21,23-26,30-32,34H,10-12H2,1-9H3/t13-,14+,15+,16+,17-,18+,19-,20+,21+,23+,24+,25+,26-,28-/m1/s1
InChIKeyJAQMVBAAUKSWIW-DDRSCQIDSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
3-O-(α-L-oleandrosyl)erythronolide B (CHEBI:63289) has functional parent erythronolide B (CHEBI:27977)
3-O-(α-L-oleandrosyl)erythronolide B (CHEBI:63289) has role metabolite (CHEBI:25212)
3-O-(α-L-oleandrosyl)erythronolide B (CHEBI:63289) is a glycoside (CHEBI:24400)
3-O-(α-L-oleandrosyl)erythronolide B (CHEBI:63289) is a macrolide (CHEBI:25106)
3-O-(α-L-oleandrosyl)erythronolide B (CHEBI:63289) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name 
(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-14-ethyl-4,6,7,12-tetrahydroxy-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-4-yl 2,6-dideoxy-3-O-methyl-α-L-arabino-hexopyranoside
Synonyms  Source
3-L-oleandrosyl-erythronolide BChEBI
L-oleandrosyl-erythronolide BChEBI
(3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-14-ethyl-6,7,12-trihydroxy-4-{[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dioneIUPAC
UniProt Name  Source
3-O-(α-L-oleandrosyl)erythronolide BUniProt
Citations