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Health_ontology
Last uploaded:
July 4, 2024
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| Preferred Name | roxatidine | |
| Synonyms |
2-hydroxy-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_230550 |
|
| alternative label |
2-hydroxy-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide
|
|
| charge |
0
|
|
| database_cross_reference |
Chemspider:82423 HMDB:HMDB0257317 KEGG:D08494
|
|
| formula |
C17H26N2O3
|
|
| has exact synonym |
2-hydroxy-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_RxCUI |
114817
|
|
| id |
CHEBI:230550
|
|
| in_subset | ||
| inchi |
InChI=1S/C17H26N2O3/c20-14-17(21)18-8-5-11-22-16-7-4-6-15(12-16)13-19-9-2-1-3-10-19/h4,6-7,12,20H,1-3,5,8-11,13-14H2,(H,18,21)
|
|
| inchikey |
BCCREUFCSIMJFS-UHFFFAOYSA-N
|
|
| label |
roxatidine
|
|
| mass |
306.406
|
|
| monoisotopicmass |
306.19434
|
|
| notation |
CHEBI:230550
|
|
| prefLabel |
roxatidine
|
|
| smiles |
O(C=1C=C(CN2CCCCC2)C=CC1)CCCNC(=O)CO
|
|
| subClassOf |
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