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Chemical structure of ACTH 22-39 (Adrenocorticotropic Hormone (22-39))

GC31507

ACTH 22-39 (Adrenocorticotropic Hormone (22-39))

Also known as (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-4-amino-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoyl]amino]acetyl]amino]propanoyl]amino]-4-carboxybutanoyl]amino]-3-carboxypropanoyl]amino]-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]amino]propanoyl]amino]-5-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-1-[[(2S)-4-carboxy-1-[[(1S)-1-carboxy-2-phenylethyl]amino]-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

ACTH 22-39 (Adrenocorticotropic Hormone (22-39)) is an adrenocorticotropic hormone (ACTH) fragment

ChemicalCAS37548-29-1MW1985.06FormulaC90H125N19O32
CAS number
37548-29-1
Molecular weight
1985.06
Formula
C90H125N19O32
Solubility
Soluble in Water
InChIKey
VNYTZTMGIJDKGF-SYGRCPSDSA-N
Catalogue number
GC31507
Brand
GLPBIO
Computed properties PubChem CID 71311732 · XLogP -5.9 · TPSA 810 Ų · H-bond donors 25
XLogP
-5.9
TPSA
810 Ų
H-bond donors
25
H-bond acceptors
33
Rotatable bonds
59
Heavy atoms
141

SMILES C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)NC(=O)CNC(=O)[C@H](CC(=O)N)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CC5=CC=C(C=C5)O)NC(=O)[C@H](C(C)C)N

Computed descriptors from PubChem (CID 71311732), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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