4''-Keto-5-O-[(2-propenyloxy)carbonyl]-Abamectin

CAS: 160094-12-2

Ref. TR-K816820

Product Information

• Name: 4''-Keto-5-O-[(2-propenyloxy)carbonyl]-Abamectin
• Synonyms: [(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-[(2S)-butan-2-yl]-24'-hydroxy-12'-[(2R,4S,5S,6S)-4-methoxy-5-[(2R,4S,6S)-4-methoxy-6-methyl-5-oxooxan-2-yl]oxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethyl-2'-oxospiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-21'-yl] prop-2-enyl carbonate
• Brand: TRC

Description

Applications 4''-Keto-5-O-[(2-propenyloxy)carbonyl]-Abamectin is a derivative of Abamectin (A107000), a mixture of avermectins, containing at least 80% of avermectin B1a (C48H72O14) and not more than 20% of avermectin B1b (C47H70O14). Used as acaricide, insecticide, Cannabis pesticide detection.
References Wang, S., et al.: Prog. Clin. Biol. Res., 97, 373 (1982); Greenblatt, J.A., et al.: J. Agric. Entomol., 3, 233 (1986); Drexler, G., et al.: Eur. J. Pharmacol., 99, 269 (1984);

Chemical properties

• Molecular weight: 955.134
• Formula: C₅₂H₇₄O₁₆
• Color/Form: Neat
• InChI: InChI=1S/C52H74O16/c1-12-21-59-50(55)66-46-32(7)22-38-49(54)63-37-23-36(67-51(26-37)20-19-31(6)45(68-51)28(3)13-2)18-17-30(5)44(29(4)15-14-16-35-27-60-48(46)52(35,38)56)64-42-25-40(58-11)47(34(9)62-42)65-41-24-39(57-10)43(53)33(8)61-41/h12,14-17,19-20,22,28-29,31,33-34,36-42,44-48,56H,1,13,18,21,23-27H2,2-11H3/b15-14+,30-17+,35-16+/t28-,29-,31-,33-,34-,36+,37-,38-,39-,40-,41-,42-,44-,45+,46+,47-,48+,51+,52+/m0/s1
• InChI key: InChIKey=YHGHLYKKPYEYNZ-RTNGKRDXSA-N
• SMILES: C=CCOC(=O)O[C@@H]1C(C)=C[C@H]2C(=O)O[C@H]3C[C@@H](C/C=C(\C)[C@@H](O[C@H]4C[C@H](OC)[C@@H](O[C@H]5C[C@H](OC)C(=O)[C@H](C)O5)[C@H](C)O4)[C@@H](C)/C=C/C=C4\CO[C@H]1[C@@]42O)O[C@@]1(C=C[C@H](C)[C@@H]([C@@H](C)CC)O1)C3