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864461-31-4,MFCD01310504
Catalog No.:AA00H07L

864461-31-4 | 7-BENZYLIDENENALTREXONE MALEATE

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Technical Information
Catalog Number:
AA00H07L
Chemical Name:
7-BENZYLIDENENALTREXONE MALEATE
CAS Number:
864461-31-4
Molecular Formula:
C31H31NO8
Molecular Weight:
545.5797
MDL Number:
MFCD01310504
SMILES:
O=C1/C(=C/c2ccccc2)/C[C@@]2([C@@]34[C@H]1Oc1c4c(C[C@H]2N(CC3)CC2CC2)ccc1O)O.OC(=O)/C=C\C(=O)O
Properties
Computed Properties
 
Complexity:
951  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
2  
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
5  

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SDS
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Tags:864461-31-4 Molecular Formula|864461-31-4 MDL|864461-31-4 SMILES|864461-31-4 7-BENZYLIDENENALTREXONE MALEATE