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CHEBI:212798 - 4'-O-beta-D-Glucose 13-hydroxyglucopiericidin A

ChEBI IDCHEBI:212798
ChEBI Name4'-O-beta-D-Glucose 13-hydroxyglucopiericidin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H57NO15
Net Charge0
Average Mass755.855
Monoisotopic Mass755.37282
SMILESCOc1nc(C/C=C(\C)C/C=C/C(C)=C/[C@@H](C)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(C)=C/CO)c(C)c(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1OC
InChIInChI=1S/C37H57NO15/c1-18(9-8-10-19(2)15-21(4)32(20(3)13-14-39)52-36-30(46)28(44)26(42)24(16-40)50-36)11-12-23-22(5)33(34(48-6)35(38-23)49-7)53-37-31(47)29(45)27(43)25(17-41)51-37/h8,10-11,13,15,21,24-32,36-37,39-47H,9,12,14,16-17H2,1-7H3/b10-8+,18-11+,19-15+,20-13+/t21-,24-,25-,26-,27-,28+,29+,30-,31-,32+,36+,37-/m1/s1
InChIKeyRMCUYRYTRDYBAY-WLYXSUAASA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (31298537)
ChEBI Ontology
Outgoing Relation(s)
4'-O-beta-D-Glucose 13-hydroxyglucopiericidin A (CHEBI:212798) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[2-[(2E,5E,7E,9R,10R,11E)-13-hydroxy-3,7,9,11-tetramethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytrideca-2,5,7,11-tetraenyl]-5,6-dimethoxy-3-methylpyridin-4-yl]oxyoxane-3,4,5-triol