CYS-BETA-AMYLOID (12-28)

CAS号
CCD编号
CCD00357253
分子式
C92 H140 N26 O26 S
分子量
2058.34

基本信息

产品名称: CYS-BETA-AMYLOID (12-28)
英文同义词: H-CYS-VAL-HIS-HIS-GLN-LYS-LEU-VAL-PHE-PHE-ALA-GLU-ASP-VAL-GLY-SER-ASN-LYS-OH ; CYS-BETA-AMYLOID (12-28) ; CVHHQKLVFFAEDVGSNK
MDL号: MFCD03093656
氢键受体数量: 52
氢键供体数量: 28
Smile: CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](Cc4c[nH]cn4)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CS)N
InChi: InChI=1S/C92H140N26O26S/c1-46(2)32-60(109-78(129)56(24-16-18-30-93)106-79(130)57(26-28-68(96)120)107-83(134)63(35-53-39-98-44-101-53)111-84(135)64(36-54-40-99-45-102-54)115-90(141)74(48(5)6)116-77(128)55(95)43-145)86(137)118-75(49(7)8)91(142)114-62(34-52-22-14-11-15-23-52)82(133)110-61(33-51-20-12-10-13-21-51)81(132)103-50(9)76(127)105-58(27-29-71(123)124)80(131)113-66(38-72(125)126)87(138)117-73(47(3)4)89(140)100-41-70(122)104-67(42-119)88(139)112-65(37-69(97)121)85(136)108-59(92(143)144)25-17-19-31-94/h10-15,20-23,39-40,44-50,55-67,73-75,119,145H,16-19,24-38,41-43,93-95H2,1-9H3,(H2,96,120)(H2,97,121)(H,98,101)(H,99,102)(H,100,140)(H,103,132)(H,104,122)(H,105,127)(H,106,130)(H,107,134)(H,108,136)(H,109,129)(H,110,133)(H,111,135)(H,112,139)(H,113,131)(H,114,142)(H,115,141)(H,116,128)(H,117,138)(H,118,137)(H,123,124)(H,125,126)(H,143,144)/t50-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,73-,74-,75-/m0/s1
InChiKey: InChIKey=UOMMBTLURREWJG-VZQYUNPOSA-N

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