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Casokefamide

Molecular FormulaC₃₃H₄₀N₆O₇
Average mass632.707 Da
Monoisotopic mass632.295837 Da
ChemSpider ID4576538

- 5 of 5 defined stereocentres

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Names and Synonyms
Database ID(s)

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

98815-38-4 [RN]

B453T1E8MP

b-Casomorphin 4027

Casokefamida [Spanish]

Casokefamide [INN] [Wiki]

Casokefamidum [Latin]

L-Tyrosinamide, L-tyrosyl-D-alanyl-L-phenylalanyl-D-alanyl- [ACD/Index Name]

L-Tyrosyl-D-alanyl-L-phenylalanyl-D-alanyl-L-tyrosinamid [German] [ACD/IUPAC Name]

L-Tyrosyl-D-alanyl-L-phenylalanyl-D-alanyl-L-tyrosinamide [ACD/IUPAC Name]

L-Tyrosyl-D-alanyl-L-phénylalanyl-D-alanyl-L-tyrosinamide [French] [ACD/IUPAC Name]

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β casomorphin 4027

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-AMINO-3-(4-HYDROXYPHENYL)PROPANAMIDO]PROPANAMIDO]-3-PHENYLPROPANAMIDO]PROPANAMIDO]-3-(4-HYDROXYPHENYL)PROPANAMIDE

(2S)-N-[(1R)-2-[[(1S)-2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxoethyl]amino]-1-methyl-2-oxoethyl]-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxopropyl]amino]-3-phenylpropanamide(2S)-N-[(1R)-2-[[(1S)-2-amino-1-(4-hydroxybenzyl)-2-keto-ethyl]amino]-2-keto-1-methyl-ethyl]-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenyl-propionamide

(2S)-N-[(1R)-2-[[(1S)-2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenyl-propanamide

(2S)-N-[(2R)-1-[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenylpropanamide

(2S)-N-[(2R)-1-[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxo-propan-2-yl]amino]-1-oxo-propan-2-yl]-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenyl-propanamide

(S)-2-Amino-N-((R)-1-(((S)-1-(((R)-1-(((S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)amino)-1-oxopropan-2-yl)amino)-1-oxo-3-phenylpropan-2-yl)amino)-1-oxopropan-2-yl)-3-(4-hydroxyphenyl)propanamide

casokefamida

Casokefamida [INN-Spanish]

casokéfamide

Casokefamide [INN]

casokefamidum

Casokefamidum [INN-Latin]

L-Tyrosinamide,L-tyrosyl-D-alanyl-L-phenylalanyl-D-alanyl- (9CI)

L-Tyrosinamide,l-tyrosyl-D-alanyl-L-phenylalanyl-D-alanyl-(9ci)

TYR-DALA-PHE-DALA-TYR-NH2

UNII:B453T1E8MP

UNII-B453T1E8MP

казокефамид [Russian]

كازوكيفاميد [Arabic]

卡索胺 [Chinese]

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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

6808 [DBID]

Predicted - ACD/Labs
Predicted - ChemAxon

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:	1.3±0.1 g/cm³
Boiling Point:	1108.9±65.0 °C at 760 mmHg
Vapour Pressure:	0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization:	168.7±3.0 kJ/mol
Flash Point:	624.4±34.3 °C
Index of Refraction:	1.619
Molar Refractivity:	170.2±0.3 cm³
#H bond acceptors:	13
#H bond donors:	10
#Freely Rotating Bonds:	15
#Rule of 5 Violations:	3

ACD/LogP:	1.38
ACD/LogD (pH 5.5):	-0.39
ACD/BCF (pH 5.5):	1.00
ACD/KOC (pH 5.5):	2.39
ACD/LogD (pH 7.4):	1.11
ACD/BCF (pH 7.4):	3.60
ACD/KOC (pH 7.4):	75.00
Polar Surface Area:	226 Å²
Polarizability:	67.5±0.5 10^-24cm³
Surface Tension:	61.3±3.0 dyne/cm
Molar Volume:	485.2±3.0 cm³

Click to predict properties on the Chemicalize site

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Casokefamide

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