General Information of the Compound
| Compound ID |
CP0139483
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| Compound Name |
(6aR,10aR)-3-(2-(3,5-dimethylphenyl)propan-2-yl)-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-ol
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| Structure |
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| Formula |
C27H34O2
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| Molecular Weight |
390.567
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| Canonical SMILES |
CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(cc1OC2(C)C)C(C)(C)c1cc(C)cc(C)c1
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| InChI |
InChI=1S/C27H34O2/c1-16-8-9-22-21(13-16)25-23(28)14-20(15-24(25)29-27(22,6)7)26(4,5)19-11-17(2)10-18(3)12-19/h8,10-12,14-15,21-22,28H,9,13H2,1-7H3/t21-,22-/m1/s1
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| InChIKey |
OWIJKSMNUUFXND-FGZHOGPDSA-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