Basic Information |
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Product Name: | PF-543 CITRATE |
CAS: | 1415562-83-2 |
English Synonyms: | PF-543 CITRATE |
MDL Number.: | MFCD23098795 |
H bond acceptor: | 5 |
H bond donor: | 1 |
Smile: | Cc1cc(cc(c1)OCc2ccc(cc2)CN3CCC[C@@H]3CO)CS(=O)(=O)c4ccccc4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
InChi: | InChI=1S/C27H31NO4S.C6H8O7/c1-21-14-24(20-33(30,31)27-7-3-2-4-8-27)16-26(15-21)32-19-23-11-9-22(10-12-23)17-28-13-5-6-25(28)18-29;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-4,7-12,14-16,25,29H,5-6,13,17-20H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t25-;/m1./s1 |
InChiKey: | InChIKey=PWXXWUWKNPXSGW-VQIWEWKSSA-N |
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