EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
We are looking for a new Chemistry curator to join the ChEBI team. Find out more about it here.
CHEBI:755161 - luminespib mesylate
| Formula | H2O.C26H31N3O5.CH4O3S |
| Net Charge | 0 |
| Average Mass | 579.672 |
| Monoisotopic Mass | 579.22505 |
| SMILES | CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1-c1ccc(CN2CCOCC2)cc1.CS(=O)(=O)O.O |
| InChI | InChI=1S/C26H31N3O5.CH4O3S.H2O/c1-4-27-26(32)24-23(18-7-5-17(6-8-18)15-29-9-11-33-12-10-29)25(34-28-24)20-13-19(16(2)3)21(30)14-22(20)31;1-5(2,3)4;/h5-8,13-14,16,30-31H,4,9-12,15H2,1-3H3,(H,27,32);1H3,(H,2,3,4);1H2 |
| InChIKey | TUURDQPZDIZCLK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| luminespib mesylate (CHEBI:755161) is a alkylbenzene (CHEBI:38976) |
| Synonyms | Source |
|---|---|
| 1051919-26-6 | ChEMBL |
| Luminespib mesylate | ChEMBL |
| Luminespib mesylate hydrate | ChEMBL |
| NVP-AUY922-AGB | ChEMBL |