92168-48-4 Purity
96%
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Specification
The PubChem CID of Neuromedin N is 9940301.
The molecular formula of Neuromedin N is C38H63N7O8.
The molecular weight of Neuromedin N is 745.9 g/mol.
The IUPAC name of Neuromedin N is (2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-1-[(2S,3S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid.
The InChI of Neuromedin N is InChI=1S/C38H63N7O8/c1-7-23(5)31(36(50)42-29(38(52)53)20-22(3)4)43-34(48)28(21-25-14-16-26(46)17-15-25)41-35(49)30-13-11-19-45(30)37(51)32(24(6)8-2)44-33(47)27(40)12-9-10-18-39/h14-17,22-24,27-32,46H,7-13,18-21,39-40H2,1-6H3,(H,41,49)(H,42,50)(H,43,48)(H,44,47)(H,52,53)/t23-,24-,27-,28-,29-,30-,31-,32-/m0/s1.
The InChIKey of Neuromedin N is RZMLVIHXZGQADB-YLUGYNJDSA-N.
The canonical SMILES of Neuromedin N is CCC(C)C(C(=O)NC(CC(C)C)C(=O)O)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2CCCN2C(=O)C(C(C)CC)NC(=O)C(CCCCN)N.
The CAS number of Neuromedin N is 102577-25-3.
The hydrogen bond donor count of Neuromedin N is 8.