AMASTATIN ,69400-55-1 _ChemCD

AMASTATIN

basic_info
Product_Name：	AMASTATIN
CAS：	69400-55-1 ;67655-94-1
EnglishSynonyms：	(AMINO-2-HYDROXY-5-METHYL-HEXANOYL)-L-VALYL-L-VALYL-L-ASPARTIC ACID ; [(2S,3R)-3-AMINO-2-HYDROXY-5-METHYL-HEXANOYL]-L-VALYL-L-VALYL-L-ASPARTIC ACID ; AMASTATIN ; N-[(2S,3R)-3-AMINO-2-HYDROXY-5-METHYLHEXANOYL]-L-VALYL-L-VALYL-L-ASPARTIC ACID ; (2S,3R)-3-AMINO-2-HYDROXY-5-METHYLHEXANOYL-VAL-VAL-ASP-OH
pro_mdlNumber：	MFCD00038400
pro_acceptors：	12
pro_donors：	7
pro_smile：	CC(C)C[C@H]([C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)O)N
InChi：	InChI=1S/C21H38N4O8/c1-9(2)7-12(22)17(28)20(31)25-16(11(5)6)19(30)24-15(10(3)4)18(29)23-13(21(32)33)8-14(26)27/h9-13,15-17,28H,7-8,22H2,1-6H3,(H,23,29)(H,24,30)(H,25,31)(H,26,27)(H,32,33)/t12-,13+,15+,16+,17+/m1/s1
InChiKey：	InChIKey=QFAADIRHLBXJJS-ZAZJUGBXSA-N
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