EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C35H45Cl2N3O6S |
| Net Charge | 0 |
| Average Mass | 706.733 |
| Monoisotopic Mass | 705.24061 |
| SMILES | C[C@@H]1CCCCO[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)[C@@H](C)CN([C@@H](C)CO)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2O1 |
| InChI | InChI=1S/C35H45Cl2N3O6S/c1-24-20-40(25(2)23-41)35(42)30-19-28(38-47(43,44)29-11-6-5-7-12-29)14-16-33(30)46-26(3)10-8-9-17-45-34(24)22-39(4)21-27-13-15-31(36)32(37)18-27/h5-7,11-16,18-19,24-26,34,38,41H,8-10,17,20-23H2,1-4H3/t24-,25-,26+,34+/m0/s1 |
| InChIKey | RXIJSVCALBVVES-BEAGFIRGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(3R,9S,10S)-9-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide (CHEBI:128177) is a azamacrocycle (CHEBI:52898) |
| N-[(3R,9S,10S)-9-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide (CHEBI:128177) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-39732 | LINCS |