General Information of the Compound
| Compound ID |
CP0908025
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| Compound Name |
SID134215382
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| Structure |
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| Formula |
C28H27FO8
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| Molecular Weight |
510.514
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| Canonical SMILES |
COC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(OC)cc(OC)cc3O[C@@]2(c2ccc(OC)cc2)[C@@H]1c1ccc(F)cc1
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| InChI |
InChI=1S/C28H27FO8/c1-33-18-11-7-16(8-12-18)28-23(15-5-9-17(29)10-6-15)22(26(31)36-4)25(30)27(28,32)24-20(35-3)13-19(34-2)14-21(24)37-28/h5-14,22-23,25,30,32H,1-4H3/t22-,23-,25-,27+,28+/m1/s1
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| InChIKey |
MXTIGVJDNJUAEQ-GWNOIRNCSA-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