basic_info |
|
| Product_Name: | N-METHYL TAXOL |
| EnglishSynonyms: | N-METHYL TAXOL |
| pro_mdlNumber: | MFCD13182334 |
| pro_acceptors: | 15 |
| pro_donors: | 3 |
| pro_smile: | CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](c5ccccc5)N(C)C(=O)c6ccccc6)O)O)OC(=O)c7ccccc7)(CO4)OC(=O)C)O)C)OC(=O)C |
| InChi: | InChI=1S/C48H53NO14/c1-26-32(61-44(57)37(53)36(29-17-11-8-12-18-29)49(7)42(55)30-19-13-9-14-20-30)24-48(58)41(62-43(56)31-21-15-10-16-22-31)39-46(6,33(52)23-34-47(39,25-59-34)63-28(3)51)40(54)38(60-27(2)50)35(26)45(48,4)5/h8-22,32-34,36-39,41,52-53,58H,23-25H2,1-7H3/t32-,33-,34+,36-,37+,38+,39-,41-,46+,47-,48+/m0/s1 |
| InChiKey: | InChIKey=UATZAEJDBCHOCI-JBTWBBNCSA-N |
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