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CHEBI:41879 - dexamethasone

ChEBI IDCHEBI:41879
ChEBI Namedexamethasone
Stars
DefinitionA fluorinated steroid that is 9-fluoropregna-1,4-diene substituted by hydroxy groups at positions 11, 17 and 21, a methyl group at position 16 and oxo groups at positions 3 and 20. It is a synthetic member of the class of glucocorticoids.
Secondary ChEBI IDsCHEBI:4461, CHEBI:41873
Last Modified30 June 2020
DownloadsMolfile

FormulaC22H29FO5
Net Charge0
Average Mass392.467
Monoisotopic Mass392.19990
SMILES[H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1
InChIKeyUREBDLICKHMUKA-CXSFZGCWSA-N

Wikipedia
Roles Classification

ChEBI Ontology
IUPAC Name 
9-fluoro-11β,17,21-trihydroxy-16α-methylpregna-1,4-diene-3,20-dione
INNs  Source
dexamethasoneWHO MedNet
dexametasona  esWHO MedNet
dexamethasonum  laWHO MedNet
dexaméthasone  frWHO MedNet
Synonyms  Source
DexamethasoneKEGG DRUG
9α-fluoro-16α-methylprednisoloneNIST Chemistry WebBook
16α-methyl-9α-fluoro-1-dehydrocortisolNIST Chemistry WebBook
1-dehydro-16α-methyl-9α-fluorohydrocortisoneNIST Chemistry WebBook
(11β,16α)-9-fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dioneChemIDplus
fluormethylprednisoloneVSDB
Brand Names  Source
DecadronKEGG DRUG
DexasoneChemIDplus
HexadrolChemIDplus
DexasonChemIDplus
DexPakChemIDplus
Zema-PakChEBI
UniProt Name  Source
dexamethasoneUniProt
Manual XrefsDatabases
D00292KEGG DRUG
DB01234DrugBank
US3007923Patent
DE1113690Patent
GB869511Patent
DexamethasoneWikipedia
HMDB0015364HMDB
C15643KEGG COMPOUND
824DrugCentral
1769VSDB
FDB001355FooDB
CPD-10549MetaCyc
Registry NumbersSources
Beilstein:2066652Beilstein
Reaxys:2066652Reaxys
CAS:50-02-2NIST Chemistry WebBook
CAS:50-02-2ChemIDplus
Citations