General Information of the Compound
| Compound ID |
CP0519492
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| Compound Name |
(6aS,10aS)-3-[(E)-N-ethoxy-C-methylcarbonimidoyl]-6,6,9-trimethyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol
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| Structure |
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| Formula |
C20H27NO3
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| Molecular Weight |
329.44
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| Canonical SMILES |
CCO\N=C(/C)c1cc(O)c2[C@H]3CC(C)=CC[C@@H]3C(C)(C)Oc2c1
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| InChI |
InChI=1S/C20H27NO3/c1-6-23-21-13(3)14-10-17(22)19-15-9-12(2)7-8-16(15)20(4,5)24-18(19)11-14/h7,10-11,15-16,22H,6,8-9H2,1-5H3/b21-13+/t15-,16-/m0/s1
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| InChIKey |
ZTFMWEOPXSXAIZ-AIEOMDLASA-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