General Information of the Compound
| Compound ID |
CP0565517
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| Compound Name |
(6aR,10aR)-6,6,9-trimethyl-3-(2-methylpentan-2-yl)-6a,7,8,10a-tetrahydrobenzo[c]chromene
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| Structure |
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| Formula |
C22H32O
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| Molecular Weight |
312.497
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| Canonical SMILES |
CCCC(C)(C)c1ccc2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1
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| InChI |
InChI=1S/C22H32O/c1-7-12-21(3,4)16-9-10-17-18-13-15(2)8-11-19(18)22(5,6)23-20(17)14-16/h9-10,13-14,18-19H,7-8,11-12H2,1-6H3/t18-,19+/m0/s1
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| InChIKey |
LCKMWFBVBATZPO-RBUKOAKNSA-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