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41093-89-4,MFCD31697781
Catalog No.:AA00C9HC

41093-89-4 | (+)-EchiMidine N-Oxide

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Technical Information
Catalog Number:
AA00C9HC
Chemical Name:
(+)-EchiMidine N-Oxide
CAS Number:
41093-89-4
Molecular Formula:
C20H31NO8
Molecular Weight:
413.4620
MDL Number:
MFCD31697781
SMILES:
CC=C(C)C(=O)OC1CC[N+]2(C1C(=CC2)COC(=O)C(C(C)O)(C(C)(C)O)O)[O-]
Properties
Computed Properties
 
Complexity:
730  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
9  
Undefined Atom Stereocenter Count:
3  
XLogP3:
-0.6  

Literature
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SDS
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Tags:41093-89-4 Molecular Formula|41093-89-4 MDL|41093-89-4 SMILES|41093-89-4 (+)-EchiMidine N-Oxide