bovine adrenal medulla peptide 8-22   Click here for help

GtoPdb Ligand ID: 4058

Abbreviated name: BAM 8-22
Synonyms: BAM (8-22) | BAM-15 | BAM-22 | BAM-22P (8-22)
Comment: This peptide is a proenkephalin A-derived agonist of the orphan GPCR, MAS related GPR family member X1 (MRGPRX1).
Species: Human
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES NCCCCC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)O)Cc1ccc(cc1)O)CCCNC(=N)N)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C1CCCN1C(=O)C(NC(=O)CNC(=O)C(C(C)C)N)CCCNC(=N)N)CCC(=O)O)CCSC)CC(=O)O)Cc1ccc(cc1)O)CCC(=O)N
Isomeric SMILES NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccc(cc1)O)CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@H](C(C)C)N)CCCNC(=N)N)CCC(=O)O)CCSC)CC(=O)O)Cc1ccc(cc1)O)CCC(=O)N
InChI InChI=1S/C91H127N25O23S/c1-48(2)76(94)88(138)103-46-72(120)105-64(19-11-36-100-91(97)98)89(139)116-37-12-20-70(116)87(137)110-62(30-32-73(121)122)81(131)113-68(42-52-45-102-58-16-7-5-14-56(52)58)85(135)114-67(41-51-44-101-57-15-6-4-13-55(51)57)84(134)109-63(33-38-140-3)82(132)115-69(43-74(123)124)86(136)112-66(40-50-23-27-54(118)28-24-50)83(133)108-61(29-31-71(93)119)80(130)106-59(17-8-9-34-92)78(128)107-60(18-10-35-99-90(95)96)79(129)111-65(77(127)104-47-75(125)126)39-49-21-25-53(117)26-22-49/h4-7,13-16,21-28,44-45,48,59-70,76,101-102,117-118H,8-12,17-20,29-43,46-47,92,94H2,1-3H3,(H2,93,119)(H,103,138)(H,104,127)(H,105,120)(H,106,130)(H,107,128)(H,108,133)(H,109,134)(H,110,137)(H,111,129)(H,112,136)(H,113,131)(H,114,135)(H,115,132)(H,121,122)(H,123,124)(H,125,126)(H4,95,96,99)(H4,97,98,100)/t59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,76-/m0/s1
InChI Key GOEYECACIBFJGZ-NPAGUKBMSA-N
Classification Click here for help
Compound class Endogenous peptide in human, mouse or rat
Ligand families/groups Neuropeptides
Synonyms Click here for help
BAM (8-22) | BAM-15 | BAM-22 | BAM-22P (8-22)
Gene/Precursor Click here for help
Gene symbol Gene name Species Precursor protein name Synonyms
PENK proenkephalin Human proenkephalin-A preproenkephalin
Database Links Click here for help
BindingDB Ligand 224021
CAS Registry No. 412961-36-5 (source: PubChem)
ChEMBL Ligand CHEMBL3343989
Ensembl Gene ENSG00000181195 (Hs)
GtoPdb PubChem SID 178100882
Human Protein Atlas ENSG00000181195 (Hs)
PubChem CID 16158367
Search Google for chemical match using the InChIKey GOEYECACIBFJGZ-NPAGUKBMSA-N
Search Google for chemicals with the same backbone GOEYECACIBFJGZ
UniChem Compound Search for chemical match using the InChIKey GOEYECACIBFJGZ-NPAGUKBMSA-N
UniChem Connectivity Search for chemical match using the InChIKey GOEYECACIBFJGZ-NPAGUKBMSA-N
UniProtKB P01210 (Hs)

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Tocris
BAM (8-22)
Cat. No. 1763