Chemical Compound

23-Keto nemadectin

CAS Registry Number 112124-81-9
23-Keto nemadectin chemical structure
Primary Record

23-Keto nemadectin

In stock
8,759 g
Purity
98.2 %
CAS
112124-81-9

Compound Identifiers & Properties

CAS
112124-81-9
PubChem CID
14012057
SMILES
C[C@@H]\1C/C(=C/C[C@@H]2C[C@@H](C[C@@]3(O2)CC(=O)[C@@H]([C@H](O3)/C(=C/C(C)C)/C)C)OC(=O)[C@@H]4C=C([C@H]([C@@H]5[C@]4(/C(=C/C=C1)/CO5)O)O)C)/C
Canonical SMILES
CC1=C[C@H]2C(=O)O[C@H]3C[C@@H](C/C=C(\C)C[C@@H](C)/C=C/C=C4\CO[C@H]([C@@H]1O)[C@@]42O)O[C@@]1(CC(=O)[C@H](C)[C@@H](/C(C)=C/C(C)C)O1)C3

Names & Synonyms

  • 23-Keto nemadectin
  • Keto-Moxidectin
  • Moxidectin Impurity 20
  • UNII-U8UGZ945KD
  • Desmethoxyamino Moxidectin
  • U8UGZ945KD
  • SCHEMBL20258539
  • 23-Desmethoxyamino-23-oxo moxidectin
  • 112124-81-9
  • C36H50O8
  • 23-Keto Nemadectin (Desmethoxyamino Moxidectin)
  • Moxidectin metabolite V (oxidation metabolite)
  • (1R,4S,5'R,6S,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2,4'-dione
  • (6R,25S)-5-O-Demethyl-28-deoxy-25-((1E)-1,3-dimethyl-1-buten-1-yl)-6,28-epoxy-23-oxomilbemycin B
  • Milbemycin B, 5-O-demethyl-28-deoxy-25-((1E)-1,3-dimethyl-1-buten-1-yl)-6,28-epoxy-23-oxo-, (6R,25S)-
  • Milbemycin B, 5-O-demethyl-28-deoxy-25-(1,3-dimethyl-1-butenyl)-6,28-epoxy-23-oxo-, (6R,25S(E))-
  • (1R,4S,5'R,6S,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-6'-[(E)-1,3-dimethylbut-1-enyl]-21,24-dihydroxy-5',11,13,22-tetramethyl-spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-tetrahydropyran]-2,4'-dione
  • (2S,2a'E,2a1'S,4'E,5R,6S,6'R,8'E,11'R,15'S,17a'R,20'R,20a'R)-2a1',20'-dihydroxy-5,6',8',19'-tetramethyl-6-((E)-4-methylpent-2-en-2-yl)-2a1',5,6,6',7',10',11',14',15',17a',20',20a'-dodecahydro-2'H,17'H-spiro[pyran-2,13'-[11,15]methano[1,5]dioxacyclooctadecino[9,8,7-cd]benzofuran]-4,17'(3H)-dione
  • (6R,25S)-5-O-Demethyl-28-deoxy-25-[(1E)-1,3-dimethyl-1-buten-1-yl]-6,28-epoxy-23-oxomilbemycin B; [6R,25S(E)]-5-O-Demethyl-28-deoxy-25-(1,3-dimethyl-1-butenyl)-6,28-epoxy-23-oxo-milbemycin B; Spiro[11,15-methano-2H,13H,17H-furo[4,3,2-pq][2,6]benzodioxacyclooctadecin-13,2'-[2H]pyran] Milbemycin B derivative;
  • Milbemycin B,5-O-demethyl-28-deoxy-25-(1,3-dimethyl-1-butenyl)-6,28-epoxy-23-oxo-, [6R,25S(E)]-
  • Spiro(11,15-methano-2H,13H,17H-furo(4,3,2-pq)(2,6)benzodioxacyclooctadecin-13,2'-(2H)pyran), milbemycin B deriv.