CALPURNINE ,6874-80-2 _ChemCD

CALPURNINE

basic_info
Product_Name：	CALPURNINE
CAS：	6874-80-2
EnglishSynonyms：	CALPURNINE
pro_mdlNumber：	MFCD01688434
pro_acceptors：	6
pro_donors：	1
pro_smile：	c1cc([nH]c1)C(=O)O[C@H]2CCN3C[C@@H]4C[C@H]([C@@H]3C2)CN5[C@@H]4CCCC5=O
InChi：	InChI=1S/C20H27N3O3/c24-19-5-1-4-17-13-9-14(12-23(17)19)18-10-15(6-8-22(18)11-13)26-20(25)16-3-2-7-21-16/h2-3,7,13-15,17-18,21H,1,4-6,8-12H2/t13-,14-,15-,17+,18-/m0/s1
InChiKey：	InChIKey=YFRYJFMFQOBOSY-YDRHNJASSA-N

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