document.write('
78700-57-9
BOC-(ASP(OBZL)16)-GASTRIN I (13-17) (HUMAN)
Name
BOC-(ASP(OBZL)16)-GASTRIN I (13-17) (HUMAN)
Formula
C43 H53 N7 O9 S
MolWeight
843.998
1Identification
【Name】
BOC-(ASP(OBZL)16)-GASTRIN I (13-17) (HUMAN)
【CAS】
【MDL】
MFCD00133635
【English Synonyms】
【Formula】
C43 H53 N7 O9 S
【MolWeight】
843.998
【Inchi】
InChI=1S/C43H53N7O9S/c1-43(2,3)59-42(57)46-25-36(51)47-34(22-29-24-45-31-18-12-11-17-30(29)31)40(55)48-32(19-20-60-4)39(54)50-35(23-37(52)58-26-28-15-9-6-10-16-28)41(56)49-33(38(44)53)21-27-13-7-5-8-14-27/h5-18,24,32-35,45H,19-23,25-26H2,1-4H3,(H2,44,53)(H,46,57)(H,47,51)(H,48,55)(H,49,56)(H,50,54)/t32-,33-,34-,35-/m0/s1
【InChIKey】
InChIKey=LHIVKTBFJFEBPW-BBACVFHCSA-N
【SMILES】
CC(C)(C)OC(=O)NCC(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)OCc3ccccc3)C(=O)N[C@@H](Cc4ccccc4)C(=O)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:7
H bond acceptor:16
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BOC-(ASP(OBZL)16)-GASTRIN I (13-17) (HUMAN).cml
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