OTAVA-FLUOR OTVD_0213_ChemCD

OTAVA-FLUOR OTVD_0213

basic_info
Product_Name：	OTAVA-FLUOR OTVD_0213
EnglishSynonyms：	OTAVA-FLUOR OTVD_0213
pro_mdlNumber：	MFCD10001174
pro_acceptors：	7
pro_donors：	3
pro_smile：	CC1=CC(=Cc2[n+](c3ccccc3s2)C)C=C(N1CCCCCC(=O)Nc4ccc(cc4)NC(=O)CCCc5c[nH]c6c5cccc6)C.[O-]Cl(=O)(=O)=O
InChi：	InChI=1S/C40H43N5O2S.ClHO4/c1-28-24-30(26-40-44(3)36-15-8-9-16-37(36)48-40)25-29(2)45(28)23-10-4-5-17-38(46)42-32-19-21-33(22-20-32)43-39(47)18-11-12-31-27-41-35-14-7-6-13-34(31)35;2-1(3,4)5/h6-9,13-16,19-22,24-27,41H,4-5,10-12,17-18,23H2,1-3H3,(H-,42,43,46,47);(H,2,3,4,5)
InChiKey：	InChIKey=GEAVDGAFMMTWFB-UHFFFAOYSA-N

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