Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L96ZOD
|
|||
| Ligand Name |
(17beta)-17-(Cyanomethyl)-2-Methoxyestra-1(10),2,4-Trien-3-Yl Sulfamate
|
|||
| Synonyms |
CHEMBL408967; (17beta)-17-(Cyanomethyl)-2-Methoxyestra-1(10),2,4-Trien-3-Yl Sulfamate; 3bet; BDBM50372895; DB07596; Q27096817; CTF
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C21H28N2O4S
|
|||
| Canonical SMILES |
CC12CCC3C(C1CCC2CC#N)CCC4=CC(=C(C=C34)OC)OS(=O)(=O)N
|
|||
| InChI |
1S/C21H28N2O4S/c1-21-9-7-15-16(18(21)6-4-14(21)8-10-22)5-3-13-11-20(27-28(23,24)25)19(26-2)12-17(13)15/h11-12,14-16,18H,3-9H2,1-2H3,(H2,23,24,25)/t14-,15+,16-,18+,21-/m1/s1
|
|||
| InChIKey |
NTSPHKOMJMBWOU-NNKXXINSSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.