Molecular Structure:
CCD No.:CCD00097016
AZADIRACHTIN B
CAS No.:
95507-03-2
Formula:C35 H44 O16
MolWeight:720.717
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| Product Name： | AZADIRACHTIN B |
| CAS： | 95507-03-2 |
| English Synonyms： | AZADIRACHTIN A ; AZADIRACHTIN B ; 3-TIGLOYL-AZADIRACHTOL |
| MDL Number.： | MFCD00210582 |
| H bond acceptor： | 16 |
| H bond donor： | 3 |
| Smile： | 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 |
| 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 |
| InChiKey： | InChIKey=FTNJWQUOZFUQQJ-NDAWSKJSSA-N |
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