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Home Other Building Blocks 187105-52-8
187105-52-8,MFCD09840328
Catalog No.:AA00AD46

187105-52-8 | 7-Deoxy Doxorubicinol Aglycone

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Technical Information
Catalog Number:
AA00AD46
Chemical Name:
7-Deoxy Doxorubicinol Aglycone
CAS Number:
187105-52-8
Molecular Formula:
C21H20O8
Molecular Weight:
400.3787
MDL Number:
MFCD09840328
SMILES:
COc1cccc2c1C(=O)c1c(O)c3CC[C@](Cc3c(c1C2=O)O)(O)C(CO)O
Properties
Computed Properties
 
Complexity:
667  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
5  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
2  
XLogP3:
2.3  

Literature
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Additional Info:
SDS
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Tags:187105-52-8 Molecular Formula|187105-52-8 MDL|187105-52-8 SMILES|187105-52-8 7-Deoxy Doxorubicinol Aglycone