Products 96722-46-2

CAS 96722-46-2 appears in our catalog under these names: 5-O-demethyl-28-hydroxy-Avermectin A1a, >95% (HPLC), 5–O–Demethyl–28–hydroxy–Avermectin A1a, 5-O-Demethyl-28-hydroxy-Avermectin A1a, 96.0%. Offered by: TRC, GLPBio, MedChemExpress. Available pack sizes: 10mg, 1mg, 5mg, 5 mg, 1 mg, 10 mg.

5-O-demethyl-28-hydroxy-Avermectin A1a, >95% (HPLC)
TRC
  • size: 10mg, 1mg, 5mg
  • Variants: 3
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5–O–Demethyl–28–hydroxy–Avermectin A1a
GLPBio
  • size: 5mg
  • Variants: 1
from 4416.33
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5-O-Demethyl-28-hydroxy-Avermectin A1a, 96.0%
MedChemExpress
  • size: 5 mg, 1 mg, 10 mg
  • Variants: 3
from 1801.13
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Structural formula: {0} (CAS {1})

(1'R,2R,3S,4'S,6S,10'E,12'S,13'S,14'E,16'Z,20'R,21'R,24'S)-2-[(2S)-butan-2-yl]-18',21',24'-trihydroxy-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-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 (CAS 96722-46-2) is a chemical compound with the molecular formula C48H72O15 and a molecular weight of 889.1 g/mol. IUPAC name: (1'R,2R,3S,4'S,6S,10'E,12'S,13'S,14'E,16'Z,20'R,21'R,24'S)-2-[(2S)-butan-2-yl]-18',21',24'-trihydroxy-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-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. InChIKey: ORIHAMOZRDYFCM-MLBVANKNSA-N.

Identity
Molecular formulaC48H72O15
Molecular weight889.1 g/mol
IUPAC name(1'R,2R,3S,4'S,6S,10'E,12'S,13'S,14'E,16'Z,20'R,21'R,24'S)-2-[(2S)-butan-2-yl]-18',21',24'-trihydroxy-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-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
InChIKeyORIHAMOZRDYFCM-MLBVANKNSA-N
SMILESCC[C@H](C)[C@@H]1[C@H](C=C[C@@]2(O1)C[C@@H]3CC(O2)C/C=C(/[C@H]([C@H](/C=C/C=C/4\C(O[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)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

Computed by PubChem (NCBI)

Synonyms: 8a hydroxy-avermectin B1a
Isomers (same molecular formula)
(1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16Z,20R,21R,24S)-6'-[(2S)-butan-2-yl]-21,24-dihydroxy-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-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2,18-dione C48H72O15