BMS-200261 TRIFLUOROACETATE

CAS号
CCD编号
CCD03255484
分子式
C46 H64 F N15 O6 . C2 H F3 O2
分子量
1056.13

基本信息

产品名称: BMS-200261 TRIFLUOROACETATE
英文同义词: 4-FLUORO-N-[(2E)-1-OXO-3-PHENYL-2-PROPEN-1-YL]-L-PHENYLALANYL-4-[(AMINOIMINOMETHYL)AMINO]-L-PHENYLALANYL-L-LEUCYL-L-ARGINYL-L-ARGININAMIDE TRIFLUOROACETATE ; BMS-200261 TRIFLUOROACETATE ; TRANS-CINNAMOYL-F(F)-F(GN)-L-R-R-AMIDE TRIFLUOROACETATE
MDL号: MFCD16875418
氢键受体数量: 21
氢键供体数量: 15
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N)NC(=O)[C@H](Cc1ccc(cc1)NC(=N)N)NC(=O)[C@H](Cc2ccc(cc2)F)NC(=O)/C=C/c3ccccc3.C(=O)(C(F)(F)F)O
InChi: InChI=1S/C46H64FN15O6.C2HF3O2/c1-27(2)24-35(41(66)60-34(11-7-23-56-45(51)52)40(65)59-33(39(48)64)10-6-22-55-44(49)50)61-43(68)37(26-30-14-19-32(20-15-30)57-46(53)54)62-42(67)36(25-29-12-17-31(47)18-13-29)58-38(63)21-16-28-8-4-3-5-9-28;3-2(4,5)1(6)7/h3-5,8-9,12-21,27,33-37H,6-7,10-11,22-26H2,1-2H3,(H2,48,64)(H,58,63)(H,59,65)(H,60,66)(H,61,68)(H,62,67)(H4,49,50,55)(H4,51,52,56)(H4,53,54,57);(H,6,7)/b21-16+;/t33-,34-,35-,36-,37-;/m0./s1
InChiKey: InChIKey=SJMXBLXVDRNKPX-QZJJLWPGSA-N

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