General Information of the Compound
| Compound ID |
CP0412001
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| Compound Name |
(1-hydroxy-9-methoxy-6,6,9-trimethyl-3-pentyl-8,10-dihydro-7H-benzo[c]chromen-10-yl) acetate
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| Structure |
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| Formula |
C24H34O5
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| Molecular Weight |
402.531
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| Canonical SMILES |
CCCCCc1cc(O)c2C3=C(CCC(C)(OC)C3OC(C)=O)C(C)(C)Oc2c1
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| InChI |
InChI=1S/C24H34O5/c1-7-8-9-10-16-13-18(26)21-19(14-16)29-23(3,4)17-11-12-24(5,27-6)22(20(17)21)28-15(2)25/h13-14,22,26H,7-12H2,1-6H3
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| InChIKey |
QNQVIRAZQPCQEB-UHFFFAOYSA-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2