BIOPEP-UWM: Report

ID 2700
Name somatostatin
sequence
AGCKNFFWKTFTSC
Function:
 
Number of residues
14
Activity code
ne
Activity :
neuropeptide
Chemical mass 1639.8920 Monoisotopic mass 1638.7299
EC50 :
0.00 µM


Bibliographic data:
Authors
Gustavsson S., Lundquist G.
Title
Inhibiton of pancreatic somatostatin release in response to glucose. Biochem. Biophys. Res. Commun., 82, 1229-1235, 1978
Year Source
1978 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: [H][C@@](C)(N)C(=O)NCC(=O)N[C@@]([H])(CS)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])(CC(N)=O)C(=O)N[C@@]([H])(Cc1ccccc1)C(=O)N[C@@]([H])(Cc1ccccc1)C(=O)N[C@@]([H])(Cc1c[nH]c2ccccc12)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@]([H])(Cc1ccccc1)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CS)C(O)=O

InChI=1S/C76H106N18O19S2/c1-41(79)64(100)82-37-61(99)83-58(39-114)73(109)85-50(27-15-17-29-77)65(101)89-56(35-60(80)98)70(106)87-52(31-44-19-7-4-8-20-44)67(103)86-53(32-45-21-9-5-10-22-45)68(104)88-55(34-47-36-81-49-26-14-13-25-48(47)49)69(105)84-51(28-16-18-30-78)66(102)93-62(42(2)96)74(110)90-54(33-46-23-11-6-12-24-46)71(107)94-63(43(3)97)75(111)91-57(38-95)72(108)92-59(40-115)76(112)113/h4-14,19-26,36,41-43,50-59,62-63,81,95-97,114-115H,15-18,27-35,37-40,77-79H2,1-3H3,(H2,80,98)(H,82,100)(H,83,99)(H,84,105)(H,85,109)(H,86,103)(H,87,106)(H,88,104)(H,89,101)(H,90,110)(H,91,111)(H,92,108)(H,93,102)(H,94,107)(H,112,113)/t41-,42+,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,62-,63-/m0/s1


InChIKey: XWJDVNOOYSANGI-ATOGVRKGSA-N


Active in oxidized form


SMILES: [H][C@@](C)(N)C(=O)NCC(=O)N[C@@]1([H])CSSC[C@]([H])(NC(=O)[C@]([H])(CO)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(Cc2ccccc2)NC(=O)[C@@]([H])(NC(=O)[C@]([H])(CCCCN)NC(=O)[C@]([H])(Cc2c[nH]c3ccccc23)NC(=O)[C@]([H])(Cc2ccccc2)NC(=O)[C@]([H])(Cc2ccccc2)NC(=O)[C@]([H])(CC(N)=O)NC(=O)[C@]([H])(CCCCN)NC1=O)[C@@H](C)O)[C@@H](C)O)C(O)=O

InChI=1S/C76H104N18O19S2/c1-41(79)64(100)82-37-61(99)83-58-39-114-115-40-59(76(112)113)92-72(108)57(38-95)91-75(111)63(43(3)97)94-71(107)54(33-46-23-11-6-12-24-46)90-74(110)62(42(2)96)93-66(102)51(28-16-18-30-78)84-69(105)55(34-47-36-81-49-26-14-13-25-48(47)49)88-68(104)53(32-45-21-9-5-10-22-45)86-67(103)52(31-44-19-7-4-8-20-44)87-70(106)56(35-60(80)98)89-65(101)50(85-73(58)109)27-15-17-29-77/h4-14,19-26,36,41-43,50-59,62-63,81,95-97H,15-18,27-35,37-40,77-79H2,1-3H3,(H2,80,98)(H,82,100)(H,83,99)(H,84,105)(H,85,109)(H,86,103)(H,87,106)(H,88,104)(H,89,101)(H,90,110)(H,91,111)(H,92,108)(H,93,102)(H,94,107)(H,112,113)/t41-,42+,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,62-,63-/m0/s1

InChIKey: NHXLMOGPVYXJNR-ATOGVRKGSA-N


Database reference:
BindingDB: ID BDBM81767

Brainpeps: ID 4

ChemIDplus: ID 0040958314

ChemSpider: ID 17288868

EPA DSSTox: ID DTXCID40116452

EROP-Moscow: ID E00128, E09881

HMRBase: ID 10022, 10023, 10265, 10267, 10268