Basic Information |
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Product Name: | AZADIRACTIN B |
CAS: | 95507-03-2 |
English Synonyms: | AZADIRACTIN B |
MDL Number.: | MFCD11042417 |
H bond acceptor: | 14 |
H bond donor: | 3 |
Smile: | [H][C@]12C[C@]([H])([C@]3(C)O[C@]13[C@]1(C)[C@H](O)[C@]3([H])OC[C@@]4([C@@H](C[C@H](O)[C@@]5(CO[C@H](C(=O)OC)[C@@]15[H])[C@@]34[H])OC(=O)C(\C)=C\C)C(=O)OC)[C@@]1(O)C=CO[C@@]1([H])O2 |
InChi: | InChI=1S/C33H42O14/c1-7-14(2)24(36)45-17-11-16(34)30-12-44-20(25(37)40-5)21(30)28(3,23(35)19-22(30)31(17,13-43-19)26(38)41-6)33-18-10-15(29(33,4)47-33)32(39)8-9-42-27(32)46-18/h7-9,15-23,27,34-35,39H,10-13H2,1-6H3/b14-7+/t15-,16+,17-,18+,19-,20+,21+,22-,23-,27+,28+,29+,30-,31+,32+,33+/m1/s1 |
InChiKey: | InChIKey=USRBWQQLHKQWAV-ZGKQVQOISA-N |
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