Chemical Compound

AZADIRACHTIN O

AZADIRACHTIN O chemical structure
Primary Record

AZADIRACHTIN O

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101747066
SMILES
CC(C)C(=O)[C@H]1C[C@H]([C@]2(CO[C@@H]3[C@@H]2[C@@]14CO[C@@H]([C@H]4[C@]([C@@H]3O)(C)[C@@]56[C@@H]7C[C@H]([C@@]5(O6)C)[C@]8(C=CO[C@H]8O7)O)C(=O)OC)C(=O)OC)OC(=O)C
Canonical SMILES
COC(=O)[C@H]1OC[C@]23[C@@H](C(=O)C(C)C)C[C@@H](OC(C)=O)[C@@]4(C(=O)OC)CO[C@@H]([C@@H](O)[C@@](C)([C@]56O[C@@]5(C)[C@H]5C[C@@H]6O[C@@H]6OC=C[C@@]65O)[C@H]12)[C@@H]43

Names & Synonyms

  • AZADIRACHTIN O
  • J2.214.072H
  • (2aR,4abeta,7aS,10bbeta)-10beta-Acetoxy-3beta-hydroxy-4alpha-methyl-8beta-isobutyryl-4beta-[[(1aR,2S,3aS,6aS,7S,7aS)-3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin]-1a(2H)-yl]-2a,3,4,4a,5,8,9,10,10a,10b-decahydro-1H-naphtho[1,8-bc:4,4a-c ]difuran-5beta,10aalpha-dicarboxylic acid dimethyl ester
  • 4,11-dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-(acetyloxy)-7-hydroxy-6-[(1S,2S,6S,8S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.02,6.09,11]dodec-3-en-9-yl]-6-methyl-14-(2-methylpropanoyl)-3,9-dioxatetracyclo[6.6.1.01,5.011,15]pentadecane-4,11-dicarboxylate