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1562369-96-3
Catalog No.:AA01EPS2

1562369-96-3 | N-[(3Z)-9-methyl-1-oxo-3-decen-1-yl]-L-α-aspartyl-(2S,3R)-2,3-diaminobutanoyl-(2R)-2-piperidinecarbonyl-(3S)-3-methyl-L-α-aspartyl-L-α-aspartylglycyl-L-α-aspartylglycyl-(2R,3R)-2,3-diaminobutanoyl-L-valyl-L-proline(11→2)-lactam

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>98.00%
3 weeks  
$988.00   $692.00
- +
5mg
>98.00%
3 weeks  
$3,092.00   $2,164.00
- +
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Technical Information
Catalog Number:
AA01EPS2
Chemical Name:
N-[(3Z)-9-methyl-1-oxo-3-decen-1-yl]-L-α-aspartyl-(2S,3R)-2,3-diaminobutanoyl-(2R)-2-piperidinecarbonyl-(3S)-3-methyl-L-α-aspartyl-L-α-aspartylglycyl-L-α-aspartylglycyl-(2R,3R)-2,3-diaminobutanoyl-L-valyl-L-proline(11→2)-lactam
CAS Number:
1562369-96-3
Molecular Formula:
C56H87N13O20
Molecular Weight:
1262.3651
SMILES:
CC(CCCC/C=C\CC(=O)N[C@H](C(=O)N[C@H]1[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H]2N(C1=O)CCCC2)[C@@H](C(=O)O)C)CC(=O)O)CC(=O)O)[C@H](N)C)C(C)C)CC(=O)O)C
Properties
Computed Properties
 
Complexity:
2670  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
11  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
89  
Hydrogen Bond Acceptor Count:
21  
Hydrogen Bond Donor Count:
15  
Rotatable Bond Count:
20  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-4  

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SDS
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Tags:1562369-96-3 Molecular Formula|1562369-96-3 MDL|1562369-96-3 SMILES|1562369-96-3 N-[(3Z)-9-methyl-1-oxo-3-decen-1-yl]-L-α-aspartyl-(2S,3R)-2,3-diaminobutanoyl-(2R)-2-piperidinecarbonyl-(3S)-3-methyl-L-α-aspartyl-L-α-aspartylglycyl-L-α-aspartylglycyl-(2R,3R)-2,3-diaminobutanoyl-L-valyl-L-proline(11→2)-lactam