PB49673382 - Small Molecule (ID:11953-101)
| HMS LINCS ID: |
11953-101
|
| Name: | PB49673382 |
| Alternative Names: | |
| LINCS ID: | |
| PubChem CID: | |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 598.09 |
| InChi: | InChI=1S/C26H23ClN6O5S2/c27-20-8-4-5-9-21(20)31-40(36,37)24-16-19(33(34)35)10-11-22(24)30-28-17-23-25(18-6-2-1-3-7-18)29-26(39-23)32-12-14-38-15-13-32/h1-11,16-17,30-31H,12-15H2/b28-17+ |
| InChi Key: | WKQHWXDENFKTTR-OGLMXYFKSA-N |
| SMILES: | O=S(C(C=C([N+]([O-])=O)C=C1)=C1N/N=C/C2=C(C3=CC=CC=C3)N=C(S2)N4CCOCC4)(NC5=C(Cl)C=CC=C5)=O |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2018-08-09 |
Batch Information for HMSL11953-101-1:
| HMS LINCS Batch ID: | 11953-101-1 |
| Provider: | UkrOrgSyntez |
| Provider Batch ID: | |
| Salt: | 101 |
| Molecular Formula: | |
| Molecular Weight: | 599.08 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2018-08-09 |
| Most Recent Update: | 2018-08-09 |
HMS QC Testing Events for HMSL11953-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 06/03/2016 | PASS | HMSL11953-101-1-MS.pdf, HMSL11953-101-1-LC.pdf |