General Information of the Compound
| Compound ID |
CP0546148
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3R,7R,9R,20R)-11-hydroxy-20-[(1R)-1-hydroxyethyl]-3,7,9-trimethyl-4,8-dioxa-21-azahexacyclo[10.9.1.02,10.03,7.016,22.017,21]docosa-1,10,12(22),14,16-pentaene-5,13-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H25NO6
|
||||||||||||||||||
| Molecular Weight |
423.465
|
||||||||||||||||||
| Canonical SMILES |
C[C@@H](O)[C@H]1CCc2c3C=CC(=O)c4c(O)c5[C@@H](C)O[C@]6(C)CC(=O)O[C@]6(C)c5c(n12)c34
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H25NO6/c1-10(26)13-6-7-14-12-5-8-15(27)19-18(12)21(25(13)14)20-17(22(19)29)11(2)30-23(3)9-16(28)31-24(20,23)4/h5,8,10-11,13,26,29H,6-7,9H2,1-4H3/t10-,11-,13-,23-,24-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
UABXYBZOZRLKEK-XNGWIOIMSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound