nociceptin/orphanin FQ   

GtoPdb Ligand ID: 1681

Abbreviated name: N/OFQ
Species: Human, Mouse, Rat
2D Structure
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SMILES / InChI / InChIKey
Canonical SMILES NCCCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)CCC(=O)N)CC(=O)N)C)CC(C)C)CCCCN)CCCNC(=N)N)C)CO)NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(C(O)C)NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)C(Cc1ccccc1)N)C)CCCNC(=N)N
Isomeric SMILES NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CC(=O)N)C)CC(C)C)CCCCN)CCCNC(=N)N)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)N)C)CCCNC(=N)N
InChI InChI=1S/C79H129N27O22/c1-41(2)33-54(72(122)95-44(5)66(116)103-56(36-59(84)110)73(123)102-53(77(127)128)27-28-58(83)109)104-70(120)49(23-13-15-29-80)100-69(119)52(26-18-32-90-79(87)88)99-65(115)43(4)96-75(125)57(40-107)105-71(121)50(24-14-16-30-81)101-68(118)51(25-17-31-89-78(85)86)98-64(114)42(3)94-61(112)39-93-76(126)63(45(6)108)106-74(124)55(35-47-21-11-8-12-22-47)97-62(113)38-91-60(111)37-92-67(117)48(82)34-46-19-9-7-10-20-46/h7-12,19-22,41-45,48-57,63,107-108H,13-18,23-40,80-82H2,1-6H3,(H2,83,109)(H2,84,110)(H,91,111)(H,92,117)(H,93,126)(H,94,112)(H,95,122)(H,96,125)(H,97,113)(H,98,114)(H,99,115)(H,100,119)(H,101,118)(H,102,123)(H,103,116)(H,104,120)(H,105,121)(H,106,124)(H,127,128)(H4,85,86,89)(H4,87,88,90)/t42-,43-,44-,45+,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,63-/m0/s1
InChI Key PULGYDLMFSFVBL-SMFNREODSA-N
Classification
Compound class Endogenous peptide in human, mouse or rat
Ligand families/groups Neuropeptides
Gene/Precursor
Gene symbol Gene name Species Precursor protein name Synonyms
PNOC prepronociceptin Human prepronociceptin (PPNOC) nocistatin, PPNOC
Pnoc prepronociceptin Mouse prepronociceptin (PPNOC) N23K, N/OFQ, Npnc1, OFQ/N, proorphanin
Pnoc prepronociceptin Rat prepronociceptin (PPNOC) N23K, neuropeptide nociceptin 1, nociceptin, Npnc1, orphanin FQ, prepronociceptin, Prepronociceptin (neuropeptide nociceptin) (N23K)
Database Links
BindingDB Ligand 21842
CAS Registry No. 170713-75-4
ChEMBL Ligand CHEMBL396460
GtoPdb PubChem SID 135651822
PubChem CID 16131448
Search Google for chemical match using the InChIKey PULGYDLMFSFVBL-SMFNREODSA-N
Search Google for chemicals with the same backbone PULGYDLMFSFVBL
Search UniChem for chemical match using the InChIKey PULGYDLMFSFVBL-SMFNREODSA-N
Search UniChem for chemicals with the same backbone PULGYDLMFSFVBL
UniProtKB Q13519 (Hs), Q64387 (Mm), Q62923 (Rn)
Wikipedia Nociceptin

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Tocris
Nociceptin
Cat. No. 0910