loading...| Preferred Name |
2-(dimethylamino)-N-[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-pent-1-ynyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylacetamide |
| ID |
http://purl.obolibrary.org/obo/CHEBI_114041 |
| charge |
0 |
| database_cross_reference |
LINCS:LSM-25473 |
| formula |
C24H37N3O5S |
| has functional parent | |
| has_obo_namespace |
chebi_ontology |
| id |
CHEBI:114041 |
| in_subset | |
| inchi |
InChI=1S/C24H37N3O5S/c1-7-8-9-10-20-11-12-23-21(13-20)32-22(15-26(6)24(29)16-25(4)5)18(2)14-27(19(3)17-28)33(23,30)31/h11-13,18-19,22,28H,7-8,14-17H2,1-6H3/t18-,19-,22+/m1/s1 |
| inchikey |
BYBGYSIHVXXZCT-KNKQGSTJSA-N |
| label |
2-(dimethylamino)-N-[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-pent-1-ynyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylacetamide |
| mass |
479.635 |
| monoisotopicmass |
479.24539 |
| notation |
CHEBI:114041 |
| prefLabel |
2-(dimethylamino)-N-[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-pent-1-ynyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylacetamide |
| smiles |
CCCC#CC1=CC2=C(C=C1)S(=O)(=O)N(C[C@H]([C@@H](O2)CN(C)C(=O)CN(C)C)C)[C@H](C)CO |
| treeView | |
| subClassOf |
| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| There are currently no mappings for this class. | |||