Chemical Compound

Avermectin A1a

CAS Registry Number 65195-51-9
Avermectin A1a chemical structure
Primary Record

Avermectin A1a

In stock
6,867 g
Purity
99.8 %
CAS
65195-51-9

Compound Identifiers & Properties

CAS
65195-51-9
PubChem CID
11239973
SMILES
CCC(C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\CO[C@H]5[C@@]4([C@@H](C=C([C@H]5OC)C)C(=O)O3)O)C)O[C@H]6C[C@@H]([C@H]([C@@H](O6)C)O[C@H]7C[C@@H]([C@H]([C@@H](O7)C)O)OC)OC)\C)C
Canonical SMILES
CCC(C)[C@H]1O[C@]2(C=C[C@@H]1C)C[C@@H]1C[C@@H](C/C=C(\C)[C@@H](O[C@H]3C[C@H](OC)[C@@H](O[C@H]4C[C@H](OC)[C@@H](O)[C@H](C)O4)[C@H](C)O3)[C@@H](C)/C=C/C=C3\CO[C@@H]4[C@H](OC)C(C)=C[C@@H](C(=O)O1)[C@]34O)O2

Names & Synonyms

  • Avermectin A1a
  • Antibiotic C 076A1a
  • UNII-YRI17ZJ0WT
  • Antibiotic C 076A(sub 1a)
  • SCHEMBL1681257
  • CHEBI:29522
  • C49H74O14
  • LMPK04000025
  • C49-H74-O14
  • CID11239973
  • C11984
  • Q27110116
  • 65195-51-9
  • (1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-2-butan-2-yl-24'-hydroxy-12'-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-21'-methoxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one