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Substance Name: Tetrahydroazadirachtin-A
RN: 108168-76-9
InChIKey: APMCZEMFQVQTHY-MDPQIKMESA-N

Note

  • An insect antifeedant.

Molecular Weight

  • 724.7482
 
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Names and Synonyms

Name of Substance

  • Tetrahydroazadirachtin-A

Synonym

  • 2',3',22,23-Tetrahydroazadirachtin

Systematic Names

  • 1H,7H-Naphtho(1,8-bc:4,4a-c')difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)-4-((1aR,2S,3aS,6aS,7S,7aS)-hexahydro-6a-hydroxy-7-methyl-2,7-methanofuro(2,3-b)oxireno(e)oxepin-1a(2H)-yl)octahydro-3,5-dihydroxy-4-methyl-8-(2-methyl-1-oxobutoxy)-, dimethyl ester, (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)-
  • 1H,7H-Naphtho(1,8-bc:4,4a-c')difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)-4-(hexahydro-

Registry Numbers

CAS Registry Number

  • 108168-76-9

System Generated Number

  • 0108168769

Structure Descriptors

InChI

1S/C35H48O16/c1-8-15(2)24(38)49-18-12-19(48-16(3)36)32(26(39)43-6)13-46-21-22(32)31(18)14-47-34(42,27(40)44-7)25(31)29(4,23(21)37)35-20-11-17(30(35,5)51-35)33(41)9-10-45-28(33)50-20/h15,17-23,25,28,37,41-42H,8-14H2,1-7H3/t15?,17-,18+,19-,20?,21-,22-,23-,25+,28+,29-,30+,31+,32+,33+,34+,35+/m1/s1

InChIKey

APMCZEMFQVQTHY-MDPQIKMESA-N

Smiles

CCC(C)C(=O)O[C@H]1C[C@H]([C@]2(CO[C@@H]3[C@@H]2[C@]14CO[C@@]([C@H]4[C@]([C@@H]3O)(C)[C@@]56C7C[C@H]([C@@]5(O6)C)[C@]8(CCO[C@H]8O7)O)(C(=O)OC)O)C(=O)OC)OC(=O)C