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CHEBI:29524 - Avermectin A1a monosaccharide

ChEBI IDCHEBI:29524
ChEBI NameAvermectin A1a monosaccharide
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC42H62O11
Net Charge0
Average Mass742.947
Monoisotopic Mass742.42921
SMILES[H][C@@]12OC/C3=C\C=C\[C@H](C)[C@H](O[C@H]4C[C@H](OC)[C@@H](O)[C@H](C)O4)/C(C)=C/C[C@@H]4C[C@@H](C[C@]5(C=C[C@H](C)[C@@H](C(C)CC)O5)O4)OC(=O)[C@H](C=C(C)[C@H]1OC)[C@]32O
InChIInChI=1S/C42H62O11/c1-10-23(2)37-26(5)16-17-41(53-37)21-31-19-30(52-41)15-14-25(4)36(51-34-20-33(46-8)35(43)28(7)49-34)24(3)12-11-13-29-22-48-39-38(47-9)27(6)18-32(40(44)50-31)42(29,39)45/h11-14,16-18,23-24,26,28,30-39,43,45H,10,15,19-22H2,1-9H3/b12-11+,25-14+,29-13+/t23?,24-,26-,28-,30+,31-,32-,33-,34-,35-,36-,37+,38+,39+,41+,42+/m0/s1
InChIKeyUFXJUDTUTIFNOY-DXLDPMLMSA-N
ChEBI Ontology
Outgoing Relation(s)
Avermectin A1a monosaccharide (CHEBI:29524) is a glycoside (CHEBI:24400)
Synonym  Source
Avermectin A1a monosaccharideKEGG COMPOUND
Manual XrefsDatabases
C11982KEGG COMPOUND