ASP-GLU-LEU-ALA-ASP-HIS-ILE-GLY-PHE-GLN-GLU-ALA-TYR-ARG

CAS号
CCD编号
CCD00739017
分子式
C73 H106 N20 O25
分子量
1663.76

基本信息

产品名称: ASP-GLU-LEU-ALA-ASP-HIS-ILE-GLY-PHE-GLN-GLU-ALA-TYR-ARG
英文同义词: OSTEOCALCIN 30-43 FRAGMENT ; ASP-GLU-LEU-ALA-ASP-HIS-ILE-GLY-PHE-GLN-GLU-ALA-TYR-ARG
MDL号: MFCD09264719
氢键受体数量: 45
氢键供体数量: 25
Smile: CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)N
InChi: InChI=1S/C73H106N20O25/c1-7-36(4)59(93-70(115)51(29-41-32-78-34-81-41)92-69(114)52(31-58(103)104)90-61(106)38(6)83-66(111)48(26-35(2)3)91-65(110)46(21-24-56(99)100)85-62(107)43(74)30-57(101)102)71(116)80-33-54(96)84-49(27-39-12-9-8-10-13-39)67(112)87-44(19-22-53(75)95)64(109)86-45(20-23-55(97)98)63(108)82-37(5)60(105)89-50(28-40-15-17-42(94)18-16-40)68(113)88-47(72(117)118)14-11-25-79-73(76)77/h8-10,12-13,15-18,32,34-38,43-52,59,94H,7,11,14,19-31,33,74H2,1-6H3,(H2,75,95)(H,78,81)(H,80,116)(H,82,108)(H,83,111)(H,84,96)(H,85,107)(H,86,109)(H,87,112)(H,88,113)(H,89,105)(H,90,106)(H,91,110)(H,92,114)(H,93,115)(H,97,98)(H,99,100)(H,101,102)(H,103,104)(H,117,118)(H4,76,77,79)/t36-,37-,38-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,59-/m0/s1
InChiKey: InChIKey=HFIORJAMVSLMET-RTAKGDRWSA-N

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