Basic Information |
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Product Name: | VINFOSILTINE |
CAS: | 123286-00-0 |
English Synonyms: | VINFOSILTINE |
MDL Number.: | MFCD00866503 |
H bond acceptor: | 15 |
H bond donor: | 5 |
Smile: | CC[C@@]1(C[C@H]2C[C@@](c3c(c4ccccc4[nH]3)CCN(C2)C1)(c5cc6c(cc5OC)N([C@@H]7[C@]68CCN9[C@H]8[C@@](C=CC9)([C@H]([C@@]7(C(=O)N[C@H](C(C)C)P(=O)(OCC)OCC)O)O)CC)C)C(=O)OC)O |
InChi: | InChI=1S/C51H72N5O10P/c1-10-47(60)27-32-28-50(46(59)64-9,40-34(19-23-55(29-32)30-47)33-17-14-15-18-37(33)52-40)36-25-35-38(26-39(36)63-8)54(7)43-49(35)21-24-56-22-16-20-48(11-2,42(49)56)44(57)51(43,61)45(58)53-41(31(5)6)67(62,65-12-3)66-13-4/h14-18,20,25-26,31-32,41-44,52,57,60-61H,10-13,19,21-24,27-30H2,1-9H3,(H,53,58)/t32-,41-,42-,43+,44+,47-,48+,49+,50-,51-/m0/s1 |
InChiKey: | InChIKey=BOELCLFVOBIXIF-MAKKXPIGSA-N |
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