General Information of the Compound
| Compound ID |
CP0519498
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| Compound Name |
(9,9,13-trimethyl-5-pentyl-8,14-dioxatetracyclo[8.5.0.02,7.013,15]pentadeca-1(10),2(7),3,5-tetraen-3-yl) acetate
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| Structure |
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| Formula |
C23H30O4
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| Molecular Weight |
370.489
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| Canonical SMILES |
CCCCCc1cc(OC(C)=O)c2C3=C(CCC4(C)OC34)C(C)(C)Oc2c1
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| InChI |
InChI=1S/C23H30O4/c1-6-7-8-9-15-12-17(25-14(2)24)20-18(13-15)26-22(3,4)16-10-11-23(5)21(27-23)19(16)20/h12-13,21H,6-11H2,1-5H3
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| InChIKey |
DUBKRSFKSZSCBP-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