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208253-85-4,MFCD07772263
Catalog No.:AA00BDPW

208253-85-4 | NOCISTATIN (BOVINE)

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Technical Information
Catalog Number:
AA00BDPW
Chemical Name:
NOCISTATIN (BOVINE)
CAS Number:
208253-85-4
Molecular Formula:
C82H135N21O32
Molecular Weight:
1927.0708
MDL Number:
MFCD07772263
SMILES:
NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CC(C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)N)CCC(=O)O)CC(C)C)CCC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)N
Properties
Computed Properties
 
Complexity:
4170  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
17  
Heavy Atom Count:
135  
Hydrogen Bond Acceptor Count:
34  
Hydrogen Bond Donor Count:
27  
Rotatable Bond Count:
68  
XLogP3:
-11.8  

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Tags:208253-85-4 Molecular Formula|208253-85-4 MDL|208253-85-4 SMILES|208253-85-4 NOCISTATIN (BOVINE)