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Chemical Entities of Biological Interest Ontology
Last uploaded:
December 1, 2024
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| Preferred Name | Tiludronic acid | |
| Synonyms |
tiludronate disodium Tiludronate Tiludronic acid |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_9598 |
|
| charge |
0
|
|
| database_cross_reference |
Drug_Central:2666 CAS:89987-06-4 HMDB:HMDB0015265 KEGG:D08599 KEGG:C08141
|
|
| formula |
C7H9ClO6P2S
|
|
| has_exact_synonym |
Tiludronic acid
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
tiludronate disodium Tiludronate
|
|
| id |
CHEBI:9598
|
|
| in_subset | ||
| inchi |
InChI=1S/C7H9ClO6P2S/c8-5-1-3-6(4-2-5)17-7(15(9,10)11)16(12,13)14/h1-4,7H,(H2,9,10,11)(H2,12,13,14)
|
|
| inchikey |
DKJJVAGXPKPDRL-UHFFFAOYSA-N
|
|
| label |
Tiludronic acid
|
|
| mass |
318.610
|
|
| monoisotopicmass |
317.92836
|
|
| notation |
CHEBI:9598
|
|
| prefLabel |
Tiludronic acid
|
|
| smiles |
OP(O)(=O)C(Sc1ccc(Cl)cc1)P(O)(O)=O
|
|
| treeView | ||
| subClassOf |
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