septide   Click here for help

GtoPdb Ligand ID: 2095

Synonyms: [pGlu6,Pro9]substance P
Comment: Synthetic analogue of substance P
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES CSCCC(C(=O)N)NC(=O)C(NC(=O)C1CCCN1C(=O)C(Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)C1CCC(=O)N1)CC(C)C
Isomeric SMILES CSCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCC(=O)N1)CC(C)C
InChI InChI=1S/C39H53N7O7S/c1-24(2)21-29(36(50)42-27(34(40)48)18-20-54-3)44-38(52)32-15-10-19-46(32)39(53)31(23-26-13-8-5-9-14-26)45-37(51)30(22-25-11-6-4-7-12-25)43-35(49)28-16-17-33(47)41-28/h4-9,11-14,24,27-32H,10,15-23H2,1-3H3,(H2,40,48)(H,41,47)(H,42,50)(H,43,49)(H,44,52)(H,45,51)/t27-,28-,29-,30-,31-,32-/m0/s1
InChI Key UUZURPUIMYJOIL-JNRWAQIZSA-N
References
1. Bellucci F, Carini F, Catalani C, Cucchi P, Lecci A, Meini S, Patacchini R, Quartara L, Ricci R, Tramontana M et al.. (2002)
Pharmacological profile of the novel mammalian tachykinin, hemokinin 1.
Br. J. Pharmacol., 135 (1): 266-74. [PMID:11786503]
2. Hastrup H, Schwartz TW. (1996)
Septide and neurokinin A are high-affinity ligands on the NK-1 receptor: evidence from homologous versus heterologous binding analysis.
FEBS Lett, 399: 264-266. [PMID:8985159]