4-{[N-乙酰基-N-(2,6-二甲基苯基)-β-丙氨酰](2-乙基-6-甲基苯基)氨基}丁酸

pro_cas
137005-17-5
pro_cdbregno
CCD00179568
pro_formula
C25 H35 N O6 S . C6 H14 N4 O2 . H2 O
pro_molWeight
669.836

basic_info

Product_Name: 4-{[N-乙酰基-N-(2,6-二甲基苯基)-β-丙氨酰](2-乙基-6-甲基苯基)氨基}丁酸
CAS: 137005-17-5
中文同义词: 4-{[N-乙酰基-N-(2,6-二甲基苯基)-β-丙氨酰](2-乙基-6-甲基苯基)氨基}丁酸
EnglishSynonyms: KSG 504 ; 4(R)-[N-(3-METHOXYPROPYL)-N-PENTYLCARBAMOYL]-5-(2-NAPHTHYLSULFONYL)PENTANOIC ACID L-ARGININE SALT MONOHYDRATE
pro_mdlNumber: MFCD00902952
pro_acceptors: 7
pro_donors: 1
pro_smile: CCCCCN(CCCOC)C(=O)[C@@H](CCC(=O)O)CS(=O)(=O)c1ccc2ccccc2c1.C(C[C@@H](C(=O)O)N)CNC(=N)N.O
InChi: InChI=1S/C25H35NO6S.C6H14N4O2.H2O/c1-3-4-7-15-26(16-8-17-32-2)25(29)22(12-14-24(27)28)19-33(30,31)23-13-11-20-9-5-6-10-21(20)18-23;7-4(5(11)12)2-1-3-10-6(8)9;/h5-6,9-11,13,18,22H,3-4,7-8,12,14-17,19H2,1-2H3,(H,27,28);4H,1-3,7H2,(H,11,12)(H4,8,9,10);1H2/t22-;4-;/m00./s1
InChiKey: InChIKey=XIGWXYNWZKIGCQ-VSVLBYNWSA-N

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