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245650-17-3,MFCD28716955
Catalog No.:AA00BI0R

245650-17-3 | L-Phenylalanine, N-[3-(3-hydroxy-4-Methoxyphenyl)propyl]-L-a-aspartyl-, 2-Methyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10mg
3 weeks  
$375.00   $262.00
- +
25mg
3 weeks  
$562.00   $393.00
- +
100mg
3 weeks  
$1,600.00   $1,120.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA00BI0R
Chemical Name:
L-Phenylalanine, N-[3-(3-hydroxy-4-Methoxyphenyl)propyl]-L-a-aspartyl-, 2-Methyl ester
CAS Number:
245650-17-3
Molecular Formula:
C24H30N2O7
Molecular Weight:
458.5042
MDL Number:
MFCD28716955
SMILES:
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NCCCc1ccc(c(c1)O)OC
Properties
Computed Properties
 
Complexity:
624  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
14  
XLogP3:
0.2  

Literature

Title: A two-generation reproductive toxicity study of the high-intensity sweetener advantame in CD rats.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20111101

Title: In vitro and in vivo assessment of the mutagenic activity of N-[N-[3-(3-hydroxy-4-methoxyphenyl) propyl]-α-aspartyl]-L-phenylalanine 1-methyl ester, monohydrate (advantame).

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20111101

Title: Chronic toxicity and carcinogenicity of N-[N-[3-(3-hydroxy-4-methoxyphenyl) propyl]-α-aspartyl]-L-phenylalanine 1-methyl ester, monohydrate (advantame) in the rat.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20111101

Title: Chronic oral toxicity of N-[N-[3-(3-hydroxy-4-methoxyphenyl) propyl]-α-aspartyl]-L-phenylalanine 1-methyl ester, monohydrate (advantame) in the dog.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20111101

Title: Evaluation of the teratogenic potential of N-[N-[3-(3-hydroxy-4-methoxyphenyl) propyl]-α-aspartyl]-L-phenylalanine 1-methyl ester, monohydrate (advantame) in the rat and rabbit.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20111101

Title: Acute and multiple-dose studies to determine the safety, tolerability, and pharmacokinetic profile of advantame in healthy volunteers.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20111101

Title: Pharmacokinetics and metabolism of N-[N-[3-(3-hydroxy-4-methoxyphenyl) propyl]-α-aspartyl]-L-phenylalanine 1-methyl ester, monohydrate (advantame) in the rat, dog, and man.

Journal: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20111101

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Tags:245650-17-3 Molecular Formula|245650-17-3 MDL|245650-17-3 SMILES|245650-17-3 L-Phenylalanine, N-[3-(3-hydroxy-4-Methoxyphenyl)propyl]-L-a-aspartyl-, 2-Methyl ester