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76808-16-7
Catalog No.:AA008P19

76808-16-7 | 2-Oxetanone,4-[(1S,3E,5R,7S,8R,9R)-8-hydroxy-1,3,5,7,9-pentamethyl-6-oxo-3-undecen-1-yl]-3-methyl-,(3S,4S)-

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1mg
≥98%
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$138.00   $96.00
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Technical Information
Catalog Number:
AA008P19
Chemical Name:
2-Oxetanone,4-[(1S,3E,5R,7S,8R,9R)-8-hydroxy-1,3,5,7,9-pentamethyl-6-oxo-3-undecen-1-yl]-3-methyl-,(3S,4S)-
CAS Number:
76808-16-7
Molecular Formula:
C20H34O4
Molecular Weight:
338.4816
SMILES:
CCC(C(C(C(=O)C(C=C(CC(C1OC(=O)C1C)C)C)C)C)O)C
NSC Number:
335650
Properties
Computed Properties
 
Complexity:
482  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
9  
Undefined Atom Stereocenter Count:
7  
XLogP3:
4.6  

Literature

Title: β-Lactone natural products and derivatives inactivate homoserine transacetylase, a target for antimicrobial agents.

Journal: The Journal of antibiotics 20110701

Title: Studies on trypsin-modified bovine and human lens acylpeptide hydrolase.

Journal: Experimental eye research 20010301

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Tags:76808-16-7 Molecular Formula|76808-16-7 MDL|76808-16-7 SMILES|76808-16-7 2-Oxetanone,4-[(1S,3E,5R,7S,8R,9R)-8-hydroxy-1,3,5,7,9-pentamethyl-6-oxo-3-undecen-1-yl]-3-methyl-,(3S,4S)-