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Antiflammin P1

HCID 164083
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Basic information

CAS
118850-71-8
Standard SMILES
CSCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CCCCN)C(=O)NC(CCCCN)C(=O)N[C@H](C(=O)NC(CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(C)C
InChIKey
XVZUZGWPOCVGGZ-NETRMLAPSA-N
Molecular formula
C45H82N12O14S2
Average molar mass
1,079.3 g/mol
Monoisotopic mass
1,078.55148768

Overview

nonapeptide fragment of uteroglobin has no phospholipase A2 inhibitory & anti-inflammatory activity; RN given refers to all (L)-isomer

Names & identifiers

Preferred name
Antiflammin P1
IUPAC
(3S)-3-[[2-[[(2S)-2-[[6-amino-2-[[(2S)-6-amino-2-[[2-[[(2S)-5-amino-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-5-oxopentanoyl]amino]-4-methylsulfanylbutanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-4-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-4-oxobutanoic acid
English name
ANTI-INFLAMMATORY PEPTIDE 1
Molecular formula
C45H82N12O14S2
Molecular weight
1079.34

Names & synonyms

Antiflammin P1MqmkkvldsAntiflammin 1Antiflamin 1MET-GLN-MET-LYS-LYS-VAL-LEU-ASP-SER118850-71-8Methionyl-glutaminyl-methionyl-lysyl-lysyl-valyl-leucyl-aspartyl-serineRefChem:915983SCHEMBL29389069(3S)-3-[[2-[[(2S)-2-[[6-amino-2-[[(2S)-6-amino-2-[[2-[[(2S)-5-amino-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-5-oxopentanoyl]amino]-4-methylsulfanylbutanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-4-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-4-oxobutanoic acidL-Serine, N-(N-(N-(N-(N2-(N2-(N-(N2-L-methionyl-L-glutaminyl)-L-methionyl)-L-lysyl)-L-lysyl)-valyl)-L-leucyl)-L-alpha-aspartyl)-PEPTIDE 1
Show more names
antiflamminp1Antiflammin-1ANTIFLAMMIN-IAF-1【peptide】ANTIFLAMMIN P IANTI-INFLAMMATORY PEPTIDE 1H-MET-GLN-MET-LYS-LYS-VAL-LEU-ASP-SER-OH

Properties

Computed structural propertiesFilling in

XLogP
-7.3
Topological polar surface area
499 Ų
Hydrogen bond donors
15
Hydrogen bond acceptors
19
Rotatable bonds
40
Heavy atoms
73
Formal charge
0
Complexity
1,820

Physicochemical properties

Boiling point
1490.7 · 1490.7±65.0 °C(Predicted)
Density
1.27 · 1.270±0.06 g/cm3(Predicted)
storage temp.
20 °C · −20°C
solubility
107.9 mg/mL · ≥107.9 mg/mL in DMSO; insoluble in EtOH; ≥21.13 mg/mL in H2O
pka
2.85 · 2.85±0.10(Predicted)
form
Lyophilized powder
Sequence
H-Met-Gln-Met-Lys-Lys-Val-Leu-Asp-Ser-OH
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
3

Chemistry & industry

Applications

UsesAntiflammin-1 is an anti-inflammatory peptide 1 (MQMKKVLDS). Antiflammin-1 is a derivative of uteroglobin. Antiflammin-1 has anti-inflammatory and antifibrotic actions in bleomycin (HY-108345)-induced lung injury[1][2][3].

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Database identifiers

CAS
118850-71-8
PubChem CID
164083