General Information of the Compound
| Compound ID |
CP0523299
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8614195, 2c
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H32O9
|
||||||||||||||||||
| Molecular Weight |
488.533
|
||||||||||||||||||
| Canonical SMILES |
CCOC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(CC)c(Cc2ccc3OCCOc3c2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H32O9/c1-3-16-6-7-17(13-18(16)11-15-5-8-19-20(12-15)33-10-9-32-19)25-24(29)23(28)22(27)21(35-25)14-34-26(30)31-4-2/h5-8,12-13,21-25,27-29H,3-4,9-11,14H2,1-2H3/t21-,22-,23+,24-,25+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
LWWYWWZUCOEFIB-RXFVIIJJSA-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 | |||||||||||||||||||
| ChEMBL 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
Protein ID: PT03804, Sodium/glucose cotransporter 1
Protein ID: PT02415, Sodium/glucose cotransporter 2