General Information of the Compound
| Compound ID |
CP0921203
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| Compound Name |
(3S,10R,13R)-3-Hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,10,11,12,13,14,15,17-tetradecahydro-cyclopenta[a]phenanthren-16-one oxime
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| Structure |
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| Formula |
C19H29NO2
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| Molecular Weight |
303.446
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| Canonical SMILES |
C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@@]43C)C1C/C(=N\O)C2
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| InChI |
InChI=1S/C19H29NO2/c1-18-7-6-16-15(17(18)10-13(11-18)20-22)4-3-12-9-14(21)5-8-19(12,16)2/h3,14-17,21-22H,4-11H2,1-2H3/b20-13+/t14-,15?,16?,17?,18+,19-/m0/s1
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| InChIKey |
OXHIQOFZFIQRIE-OVQRRRNKSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound