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CHEBI:29613 - 3-O-(α-L-oleandrosyl)oleandolide

ChEBI IDCHEBI:29613
ChEBI Name3-O-(α-L-oleandrosyl)oleandolide
Stars
ASCII Name3-O-(alpha-L-oleandrosyl)oleandolide
DefinitionA macrolide that is oleandolide having a 2,6-dideoxy-3-O-methyl-α-Larabino-hexopyranosyl (α-L-oleandrosyl) residue attached at position 3.
Last Modified6 August 2014
DownloadsMolfile
FormulaC27H46O10
Net Charge0
Average Mass530.655
Monoisotopic Mass530.30910
SMILESCO[C@H]1C[C@H](O[C@H]2[C@H](C)[C@@H](O)[C@@H](C)C[C@@]3(CO3)C(=O)[C@H](C)[C@@H](O)[C@@H](C)[C@@H](C)OC(=O)[C@@H]2C)O[C@@H](C)[C@@H]1O
InChIInChI=1S/C27H46O10/c1-12-10-27(11-34-27)25(31)15(4)22(29)13(2)17(6)36-26(32)16(5)24(14(3)21(12)28)37-20-9-19(33-8)23(30)18(7)35-20/h12-24,28-30H,9-11H2,1-8H3/t12-,13-,14+,15+,16+,17+,18-,19-,20-,21-,22-,23-,24-,27+/m0/s1
InChIKeyWBLQSDZLJBWRPL-WQMXQYMNSA-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)oleandolide (CHEBI:29613) has functional parent oleandolide (CHEBI:29658)
3-O-(α-L-oleandrosyl)oleandolide (CHEBI:29613) has role metabolite (CHEBI:25212)
3-O-(α-L-oleandrosyl)oleandolide (CHEBI:29613) is a glycoside (CHEBI:24400)
3-O-(α-L-oleandrosyl)oleandolide (CHEBI:29613) is a macrolide (CHEBI:25106)
3-O-(α-L-oleandrosyl)oleandolide (CHEBI:29613) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name 
(3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6,14-dihydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-α-L-arabino-hexopyranoside
Synonym  Source
L-Oleandrosyl-oleandolideKEGG COMPOUND
UniProt Name  Source
L-oleandrosyl-oleandolideUniProt
Manual XrefsDatabases
C11992KEGG COMPOUND
LMPK04000033LIPID MAPS
Citations