CAS Number
Molecular Formula
C35H44O16
Product format
Neat
Molecular Weight
720.70
Storage
-20°C
Shipping
Room Temperature
API Family
Synonyms
Azadirachtin A, Nimbicidine, NeemAzal, bioneem, Nimurin, Ornazin, Azatin, Suneem, Superneem, Ecozin, Gronim, Oikos, Safer BioNEEM, O4U1SAF85H, BIOSAL, CHEBI:2942, DTXSID0037497, NSC-368675, azadyrachtin, 1H, 7H-Naphtho(1, 8-bc:4, 4a-c')difuran-5, 10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3, 5-dihydroxy-4-methyl-8-(((2E)-2-methyl-1-oxo-2-butenyl)oxy)-4-((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)-, dimethyl ester, (2aR, 3S, 4S, 4aR, 5S, 7aS, 8S, 10R, 10aS and 10bR)-
Smiles
C/C=C(\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@@]56[C@@H]7C[C@H]([C@@]5(O6)C)[C@]8(C=CO[C@H]8O7)O)(C(=O)OC)O)C(=O)OC)OC(=O)C
Iupac Name
dimethyl (1S, 4S, 5R, 6S, 7S, 8R, 11S, 12R, 14S, 15R)-12-acetyloxy-4, 7-dihydroxy-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-[(E)-2-methylbut-2-enoyl]oxy-3, 9-dioxatetracyclo[6.6.1.01, 5.011, 15]pentadecane-4 and 11-dicarboxylate
InChI
InChI=1S/C35H44O16/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/h8-10,17-23,25,28,37,41-42H,11-14H2,1-7H3/b15-8+/t17-,18+,19-,20+,21-,22-,23-,25+,28+,29-,30+,31+,32+,33+,34+,35+/m1/s1
