Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BND69V
|
|||
| Binder Name |
(2E)-2-[(1S,9Z,11S,13S,17R,18R,20R,27S,29R,30R,31S)-14,26-Di(cyclohex-2-en-1-yl)-19-phenyl-21-oxa-8,19-diaza-14,26-diazoniadecacyclo[24.5.2.211,14.01,27.02,7.08,31.010,18.013,17.020,30.024,29]pentatriaconta-2,4,6,9,23-pentaen-35-ylidene]ethanol;dibromide
|
|||
| Synonyms |
CHEMBL415569
Click to Show/Hide
|
|||
| Binder Type |
Small molecular drug
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C50H60Br2N4O2
|
|||
| Canonical SMILES |
C1CC=CC(C1)[N+]23CC[C@H]4[C@@H]2C[C@@H](/C(=C\\CO)/C3)/C/5=C/N6[C@H]7[C@H]8[C@H]9C[C@H]1[C@@]7(CC[N+]1(CC9=CCO[C@H]8N([C@H]45)C1=CC=CC=C1)C1CCCC=C1)C1=CC=CC=C16.[Br-].[Br-]
|
|||
| InChI |
1S/C50H60N4O2.2BrH/c55-26-21-33-31-53(36-14-6-2-7-15-36)24-20-38-44(53)28-39(33)41-30-51-43-19-11-10-18-42(43)50-23-25-54(37-16-8-3-9-17-37)32-34-22-27-56-49(46(48(50)51)40(34)29-45(50)54)52(47(38)41)35-12-4-1-5-13-35;;/h1,4-6,8,10-14,16,18-19,21-22,30,36-40,44-49,55H,2-3,7,9,15,17,20,23-29,31-32H2;2*1H/q+2;;/p-2/b33-21-,41-30-;;/t36?,37?,38-,39-,40-,44-,45-,46+,47+,48-,49+,50+,53?,54?;;/m0../s1
|
|||
| InChIKey |
HIKALAMHAXPLDW-RCCNGQCQSA-L
|
|||
| 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.