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desmopressin
A synthetic analogue of vasopressin in which 3-mercaptopropionic acid replaces the cysteine residue at position 1 and D-arginine replaces the residue at position 8. An antidiuretic, it increases urine concentration and decreases urine production, and is used (usually as the trihydrate of the acetic acid salt) to prevent and control excessive thirst, urination, and dehydration caused by injury, surgery, and certain medical conditions. It is also used in the diagnosis and treatment of cranial diabetes insipidus and in tests of renal function.


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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 pharmacological uses [CHEBI:52210] (736) 
 agonist [CHEBI:48705] (68) 
 hormone agonist [CHEBI:51060] (13) 
 vasopressin receptor agonist [CHEBI:59727] (2) 
 desmopressin [CHEBI:4450] (1)
05. Industrial Uses 
05. Industrial Uses
 pharmaceutical [CHEBI:52217] (1978) 
 drug [CHEBI:23888] (1930) 
 renal agent [CHEBI:35846] (3) 
 desmopressin [CHEBI:4450] (1)
 diagnostic agent [CHEBI:33295] (53) 
 desmopressin [CHEBI:4450] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 pnictogen molecular entity [CHEBI:33302] (10027) 
 nitrogen molecular entity [CHEBI:51143] (7930) 
 amide [CHEBI:32988] (1863) 
 primary amide [CHEBI:33256] (1586) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 organonitrogen compound [CHEBI:35352] (6705) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 organic amino compound [CHEBI:50047] (2472) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 chalcogen molecular entity [CHEBI:33304] (15225) 
 oxygen molecular entity [CHEBI:25806] (14414) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organonitrogen compound [CHEBI:35352] (6705) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 organic amino compound [CHEBI:50047] (2472) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carboxamide [CHEBI:37622] (1381) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
 organic amino compound [CHEBI:50047] (2472) 
 peptide [CHEBI:16670] (730) 
 cyclic peptide [CHEBI:23449] (75) 
 heterodetic cyclic peptide [CHEBI:24533] (29) 
 desmopressin [CHEBI:4450] (1)
ChEBI Compound Accession Identifier  [CHEBI:4450]
ChEBI Compound Description  A synthetic analogue of vasopressin in which 3-mercaptopropionic acid replaces the cysteine residue at position 1 and D-arginine replaces the residue at position 8. An antidiuretic, it increases urine concentration and decreases urine production, and is used (usually as the trihydrate of the acetic acid salt) to prevent and control excessive thirst, urination, and dehydration caused by injury, surgery, and certain medical conditions. It is also used in the diagnosis and treatment of cranial diabetes insipidus and in tests of renal function.
ChEBI Compound Identification Number  4450
ChEBI InChI Value  InChI=1S/C46H64N14O12S2/c47-35(62)15-14-29-40(67)58-32(22-36(48)63)43(70)59-33(45(72)60-18-5-9-34(60)44(71)56-28(8-4-17-52-46(50)51)39(66)53-23-37(49)64)24-74-73-19-16-38(65)54-30(21-26-10-12-27(61)13-11-26)41(68)57-31(42(69)55-29)20-25-6-2-1-3-7-25/h1-3,6-7,10-13,28-34,61H,4-5,8-9,14-24H2,(H2,47,62)(H2,48,63)(H2,49,64)(H,53,66)(H,54,65)(H,55,69)(H,56,71)(H,57,68)(H,58,67)(H,59,70)(H4,50,51,52)/t28-,29+,30+,31+,32+,33+,34+/m1/s1
ChEBI InChIKey Value  NFLWUMRGJYTJIN-PNIOQBSNSA-N
ChEBI Compound Name  desmopressin
ChEBI SMILES Value  NC(=N)NCCC[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)NCC(N)=O
ChEBI Substance ID  99319081
ChEBI URL  ChEBI:4450
ChemSpider ID  NS
Ontomatica Chemical Accession Key (OnChAKey)  NFLWUMRGJYTJIN_PNIOQBSNSA_N_000_000000
PubChem Compound ID  5311065