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loading...| Preferred Name |
ertapenem(1-) |
| Definitions |
The mono-anion resulting from the removal of a proton from one of the carboxyic acid groups of ertapenem. |
| ID |
http://purl.obolibrary.org/obo/CHEBI_60071 |
| charge |
-1 |
| database_cross_reference |
Beilstein:8177331 |
| definition |
The mono-anion resulting from the removal of a proton from one of the carboxyic acid groups of ertapenem. |
| formula |
C22H24N3O7S |
| has_obo_namespace |
chebi_ontology |
| id |
CHEBI:60071 |
| in_subset | |
| inchi |
InChI=1S/C22H25N3O7S/c1-9-16-15(10(2)26)20(28)25(16)17(22(31)32)18(9)33-13-7-14(23-8-13)19(27)24-12-5-3-4-11(6-12)21(29)30/h3-6,9-10,13-16,23,26H,7-8H2,1-2H3,(H,24,27)(H,29,30)(H,31,32)/p-1/t9-,10-,13+,14+,15-,16-/m1/s1 |
| inchikey |
JUZNIMUFDBIJCM-ANEDZVCMSA-M |
| is conjugate base of | |
| label |
ertapenem(1-) |
| mass |
474.50700 |
| monoisotopicmass |
474.13404 |
| notation |
CHEBI:60071 |
| prefLabel |
ertapenem(1-) |
| smiles |
[H][C@]1(C[NH2+][C@@]([H])(C1)C(=O)Nc1cccc(c1)C([O-])=O)SC1=C(N2C(=O)[C@]([H])([C@@H](C)O)[C@@]2([H])[C@H]1C)C([O-])=O |
| treeView | |
| subClassOf |
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| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| http://purl.obolibrary.org/obo/CHEBI_60071 | The Drug Ontology / 药物本体 | LOOM | |
| http://purl.obolibrary.org/obo/CHEBI_60071 | The Drug Ontology / 药物本体 | SAME_URI |