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Home Other Building Blocks 68035-45-0
68035-45-0,MFCD11042250
Catalog No.:AA01X4S1

68035-45-0 | [1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-6-ol, 5b,6,7,12b,13,14-hexahydro-5b,13-dimethyl-, (5bR,6S,12bR)-

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Technical Information
Catalog Number:
AA01X4S1
Chemical Name:
[1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-6-ol, 5b,6,7,12b,13,14-hexahydro-5b,13-dimethyl-, (5bR,6S,12bR)-
CAS Number:
68035-45-0
Molecular Formula:
C21H21NO5
Molecular Weight:
367.3951
MDL Number:
MFCD11042250
SMILES:
CN1Cc2c3OCOc3ccc2[C@@]2([C@H]1c1cc3OCOc3cc1C[C@@H]2O)C
Properties
Computed Properties
 
Complexity:
603  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
XLogP3:
2.7  

Literature

Title: Identification of cytochrome P450 (CYP) isoforms involved in the metabolism of corynoline, and assessment of its herb-drug interactions.

Journal: Phytotherapy research : PTR 20110201

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Tags:68035-45-0 Molecular Formula|68035-45-0 MDL|68035-45-0 SMILES|68035-45-0 [1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-6-ol, 5b,6,7,12b,13,14-hexahydro-5b,13-dimethyl-, (5bR,6S,12bR)-