25-Cyclohexyl-4'-O-de(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-5-O-demethyl-25-de(1-methylpropyl)-Avermectin A1a
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- structure.search.product.name 25-Cyclohexyl-4'-O-de(2,6-dideoxy-3-O-methyl-a-L-arabino-hexopyranosyl)-5-O-demethyl-25-de(1-methylpropyl)-Avermectin A1a
- Product Code: TRC-C988223
- CAS Number: 165108-44-1
- Brand: TRC
Product Overview
Product Code
TRC-C988223
CAS Number
Product Format
Neat
Molecular Formula
C43 H62 O11
Molecular Weight
754.94
Product Categories
TRC, Pharmaceutical and Veterinary Residue Reference Materials , Pharmaceutical and veterinary compounds and metabolites Reference Materials , Pharmaceutical, Veterinary Compound & Metabolite Reference Materials , API Reference Standards & Research Materials
Product Type
APIDocumentation
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Product Information
Chemical Data
Analyte Name
25-Cyclohexyl-4'-O-de(2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranosyl)-5-O-demethyl-25-de(1-methylpropyl)-Avermectin A1a
CAS Number
165108-44-1
Molecular Formula
C43 H62 O11
Molecular Weight
754.94
Accurate Mass
754.4292
SMILES
CO[C@H]1C[C@H](O[C@H]2[C@@H](C)\C=C\C=C/3\CO[C@@H]4[C@H](O)C(=C[C@@H](C(=O)O[C@H]5C[C@@H](C\C=C\2/C)O[C@@]6(C5)O[C@H](C7CCCCC7)[C@@H](C)C=C6)[C@]34O)C)O[C@@H](C)[C@@H]1O
InChI
InChI=1S/C43H62O11/c1-24-11-10-14-30-23-49-40-36(44)27(4)19-33(43(30,40)47)41(46)51-32-20-31(16-15-25(2)38(24)52-35-21-34(48-6)37(45)28(5)50-35)53-42(22-32)18-17-26(3)39(54-42)29-12-8-7-9-13-29/h10-11,14-15,17-19,24,26,28-29,31-40,44-45,47H,7-9,12-13,16,20-23H2,1-6H3/b11-10+,25-15+,30-14-/t24-,26-,28-,31+,32-,33-,34-,35-,36+,37-,38-,39-,40+,42+,43+/m0/s1
IUPAC
(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-cyclohexyl-21',24'-dihydroxy-12'-[(2R,4S,5S,6S)-5-hydroxy-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
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
API
Product Format
Neat
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