DECA-SUBSTANCE P ACETATE SALT

CAS号
CCD编号
CCD00064561
分子式
C57 H86 N14 O12 S . C2 H4 O2
分子量
1251.51

基本信息

产品名称: DECA-SUBSTANCE P ACETATE SALT
英文同义词: DECA-SUBSTANCE P ACETATE SALT ; PRO-LYS-PRO-GLN-GLN-PHE-PHE-GLY-LEU-MET-NH2 ACETATE SALT ; SUBSTANCE P FRAGMENT 2-11 ACETATE SALT
MDL号: MFCD00133823
氢键受体数量: 26
氢键供体数量: 13
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCN)NC(=O)[C@@H]4CCCN4.CC(=O)O
InChi: InChI=1S/C57H86N14O12S.C2H4O2/c1-34(2)30-42(54(80)65-37(49(61)75)25-29-84-3)64-48(74)33-63-50(76)43(31-35-14-6-4-7-15-35)69-55(81)44(32-36-16-8-5-9-17-36)70-53(79)39(21-23-46(59)72)66-52(78)40(22-24-47(60)73)67-56(82)45-20-13-28-71(45)57(83)41(18-10-11-26-58)68-51(77)38-19-12-27-62-38;1-2(3)4/h4-9,14-17,34,37-45,62H,10-13,18-33,58H2,1-3H3,(H2,59,72)(H2,60,73)(H2,61,75)(H,63,76)(H,64,74)(H,65,80)(H,66,78)(H,67,82)(H,68,77)(H,69,81)(H,70,79);1H3,(H,3,4)/t37-,38-,39-,40-,41-,42-,43-,44-,45-;/m0./s1
InChiKey: InChIKey=ILWFZTOXUZATSL-PKUMMGJCSA-N

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