ACTH (4-10), Phe(7)- structure

ACTH (4-10), Phe(7)-

(4S)-4-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-(carboxymethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

Also Known As: ACTH (4-10), phe(7)-|7-Phe-acth (4-10)|7-Phenylalanyl-corticotropin (4-10)|ACTH (4-10), phenylalanine(7)-|SID:134221934|(4S)-4-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-(carboxymethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid|Glycine, N-(N-(N2-(N-(N-(N-L-methionyl-L-alpha-glutamyl)-L-histidyl)-D-phenylalanyl)-L-arginyl)-L-tryptophyl)-|(4S)-4-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-(carboxymethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4H-imidazol-|l-methionyl-l-|A-glutamyl-3-(4h-imidazol-4-yl)-l-alanyl-d-phenylalanyl-n5-(diaminomethylidene)-l-ornithyl-l-tryptophylglycine

CAS: 5246-34-4
Molecular Formula C44H59N13O10S
Molecular Weight 961.42285 g/mol
LogP -3.4
Topological Polar Surface Area 405.0 Ų
Hydrogen Bond Donors 12
Hydrogen Bond Acceptors 14
Rotatable Bonds 29
Exact Mass 961.42285
Monoisotopic Mass 961.42285
Heavy Atoms 68
Complexity 1830.0

Chemical Identifiers

CAS Number 5246-34-4
SMILES CSCC[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1C=NC=N1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)NCC(=O)O)N
InChIKey MASYCGZZLIHAQA-ZBBKWRRVSA-N

Product Overview

ACTH (4-10), Phe(7)- (CAS 5246-34-4), with molecular formula C44H59N13O10S and molecular weight 961.42285 g/mol. IUPAC: (4S)-4-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-(carboxymethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid.

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