Neurokinin A(4-10)

(3S)-3-amino-4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid

Also Known As: neurokinin A(4-10)|Neurokinin A (4-10)|Nka-(4-10)|[Ser5]neurokinin A(4-10)|A-Neurokinin Fragment 4-10|HY-P0236|NEUROKININ A (4 - 10)|NKA(4-10)|H-Asp-Ser-Phe-Val-Gly-Leu-Met-NH2|CS-7094|(3S)-3-amino-4-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid|l-|A-aspartyl-l-seryl-l-phenylalanyl-l-valylglycyl-l-leucyl-l-methioninamide|L-Methioninamide, L-a-aspartyl-L-seryl-L-phenylalanyl-L-valylglycyl-L-leucyl-|L-Methioninamide, L-alpha-aspartyl-L-seryl-L-phenylalanyl-L-valylglycyl-L-leucyl-|(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-[({[(1S)-1-{[(1S)-1-carbamoyl-3-(methylsulfanyl)propyl]carbamoyl}-3-methylbutyl]carbamoyl}methyl)carbamoyl]-2-methylpropyl]carbamoyl}-2-phenylethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}propanoic acid|(5S,8S,14S,17S,20S,23S)-23-Amino-17-benzyl-7,10,13,16,19,22-hexahydroxy-5-[hydroxy(imino)methyl]-20-(hydroxymethyl)-8-(2-methylpropyl)-14-(propan-2-yl)-2-thia-6,9,12,15,18,21-hexaazapentacosa-6,9,12,15,18,21-hexaen-25-oic acid|23-Amino-17-benzyl-7,10,13,16,19,22-hexahydroxy-5-[hydroxy(imino)methyl]-20-(hydroxymethyl)-8-(2-methylpropyl)-14-(propan-2-yl)-2-thia-6,9,12,15,18,21-hexaazapentacosa-6,9,12,15,18,21-hexaen-25-oic acid|3-Amino-N-(1-{1-[1-({[1-(1-carbamoyl-3-methylsulfanyl-propylcarbamoyl)-3-methyl-butylcarbamoyl]-methyl}-carbamoyl)-2-methyl-propylcarbamoyl]-2-phenyl-ethylcarbamoyl}-2-hydroxy-ethyl)-succinamic acid

Molecular Formula	C34H54N8O10S
Molecular Weight	766.36835 g/mol
LogP	-2.5
Topological Polar Surface Area	301.24 Ų
Hydrogen Bond Donors	10
Hydrogen Bond Acceptors	11
Rotatable Bonds	24
Exact Mass	766.36835
Heavy Atoms	53
Complexity	1414.7

Chemical Identifiers

CAS Number	97559-35-8
SMILES	CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)N