loading...| Preferred Name |
fludrocortisone |
| Synonyms |
fludrocortisonum 9ALPHA-FLUOROCORTISOL 9-fluoro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione Fludrocortisone fludrocortisone fludrocortisona |
| ID |
http://purl.obolibrary.org/obo/CHEBI_50885 |
| charge |
0 |
| database_cross_reference |
DrugBank:DB00687 CAS:127-31-1 Patent:GB792224 KEGG:D07967 PDBeChem:ZK5 LIPID_MAPS_instance:LMST02030103 Wikipedia:Fludrocortisone Patent:US2852511 KEGG:C07004 Beilstein:3014278 |
| formula |
C21H29FO5 |
| has parent hydride | |
| has role | |
| has_alternative_id |
CHEBI:46556 CHEBI:5101 |
| has_exact_synonym |
9-fluoro-11beta,17,21-trihydroxypregn-4-ene-3,20-dione Fludrocortisone |
| has_obo_namespace |
chebi_ontology |
| has_related_synonym |
fludrocortisonum 9ALPHA-FLUOROCORTISOL fludrocortisone fludrocortisona |
| id |
CHEBI:50885 |
| in_subset | |
| inchi |
InChI=1S/C21H29FO5/c1-18-7-5-13(24)9-12(18)3-4-15-14-6-8-20(27,17(26)11-23)19(14,2)10-16(25)21(15,18)22/h9,14-16,23,25,27H,3-8,10-11H2,1-2H3/t14-,15-,16-,18-,19-,20-,21-/m0/s1 |
| inchikey |
AAXVEMMRQDVLJB-BULBTXNYSA-N |
| label |
fludrocortisone |
| mass |
380.45036 |
| monoisotopicmass |
380.19990 |
| notation |
CHEBI:50885 |
| prefLabel |
fludrocortisone |
| smiles |
[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)CC[C@]12C |
| treeView |
http://purl.obolibrary.org/obo/CHEBI_35346 http://purl.obolibrary.org/obo/CHEBI_61313 http://purl.obolibrary.org/obo/CHEBI_35342 http://purl.obolibrary.org/obo/CHEBI_35344 http://purl.obolibrary.org/obo/CHEBI_50830 http://purl.obolibrary.org/obo/CHEBI_47909 |
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_35346 http://purl.obolibrary.org/obo/CHEBI_61313 http://purl.obolibrary.org/obo/CHEBI_35342 http://purl.obolibrary.org/obo/CHEBI_35344 http://purl.obolibrary.org/obo/CHEBI_50830 http://purl.obolibrary.org/obo/CHEBI_47909 |