General Information of the Compound
| Compound ID |
CP0818422
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| Compound Name |
8-methoxymethoxy-15,18,18-trimethyl-(1S,5S)-2,4-dioxatetracyclo[12.3.1.01,5.06,11]octadeca-6(11),7,9,14-tetraene-3,12-dione
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| Structure |
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| Formula |
C21H24O6
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| Molecular Weight |
372.417
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| Canonical SMILES |
COCOc1ccc2c(c1)[C@@H]1OC(=O)O[C@]13CCC(C)=C(CC2=O)C3(C)C
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| InChI |
InChI=1S/C21H24O6/c1-12-7-8-21-18(26-19(23)27-21)15-9-13(25-11-24-4)5-6-14(15)17(22)10-16(12)20(21,2)3/h5-6,9,18H,7-8,10-11H2,1-4H3/t18-,21+/m0/s1
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| InChIKey |
OMTPGSMKPIDTAU-GHTZIAJQSA-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