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CHEBI:29530 - Avermectin A2a monosaccharide

ChEBI IDCHEBI:29530
ChEBI NameAvermectin A2a monosaccharide
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC42H64O12
Net Charge0
Average Mass760.962
Monoisotopic Mass760.43978
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@H](O)[C@H](C)[C@@H](C(C)CC)O5)O4)OC(=O)[C@H](C=C(C)[C@H]1OC)[C@]32O
InChIInChI=1S/C42H64O12/c1-10-22(2)37-26(6)32(43)20-41(54-37)19-30-17-29(53-41)15-14-24(4)36(52-34-18-33(47-8)35(44)27(7)50-34)23(3)12-11-13-28-21-49-39-38(48-9)25(5)16-31(40(45)51-30)42(28,39)46/h11-14,16,22-23,26-27,29-39,43-44,46H,10,15,17-21H2,1-9H3/b12-11+,24-14+,28-13+/t22?,23-,26-,27-,29+,30-,31-,32-,33-,34-,35-,36-,37+,38+,39+,41-,42+/m0/s1
InChIKeyWYNHYWYYKJUGGV-KDLGWSGBSA-N
ChEBI Ontology
Outgoing Relation(s)
Avermectin A2a monosaccharide (CHEBI:29530) is a glycoside (CHEBI:24400)
Synonym  Source
Avermectin A2a monosaccharideKEGG COMPOUND
Manual XrefsDatabases
C11974KEGG COMPOUND