CHEBI:3077 - betamethasone

ChEBI IDCHEBI:3077
ChEBI Namebetamethasone
Stars
Last Modified7 February 2018
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-/m0/s1
InChIKeyUREBDLICKHMUKA-DVTGEIKXSA-N
Wikipedia
Roles Classification
Biological Roles:
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
hormone  Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
Applications:
anti-asthmatic agent  Any compound that has anti-asthmatic effects.
immunosuppressive agent  An agent that suppresses immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-cells or by inhibiting the activation of helper cells. In addition, an immunosuppressive agent is a role played by a compound which is exhibited by a capability to diminish the extent and/or voracity of an immune response.
anti-inflammatory drug  A substance that reduces or suppresses inflammation.
ChEBI Ontology
Outgoing Relation(s)
betamethasone (CHEBI:3077) has parent hydride pregnane (CHEBI:8386)
betamethasone (CHEBI:3077) has role anti-asthmatic agent (CHEBI:65023)
betamethasone (CHEBI:3077) has role anti-inflammatory drug (CHEBI:35472)
betamethasone (CHEBI:3077) has role immunosuppressive agent (CHEBI:35705)
betamethasone (CHEBI:3077) is a 11β-hydroxy steroid (CHEBI:35346)
betamethasone (CHEBI:3077) is a 17α-hydroxy steroid (CHEBI:35342)
betamethasone (CHEBI:3077) is a 20-oxo steroid (CHEBI:36885)
betamethasone (CHEBI:3077) is a 21-hydroxy steroid (CHEBI:35344)
betamethasone (CHEBI:3077) is a 3-oxo-Δ14-steroid (CHEBI:77166)
betamethasone (CHEBI:3077) is a fluorinated steroid (CHEBI:50830)
betamethasone (CHEBI:3077) is a glucocorticoid (CHEBI:24261)
betamethasone (CHEBI:3077) is a primary α-hydroxy ketone (CHEBI:139590)
betamethasone (CHEBI:3077) is a tertiary α-hydroxy ketone (CHEBI:139592)
Incoming Relation(s)
betamethasone acetate (CHEBI:31275) has functional parent betamethasone (CHEBI:3077)
betamethasone acibutate (CHEBI:50894) has functional parent betamethasone (CHEBI:3077)
betamethasone dipropionate (CHEBI:31276) has functional parent betamethasone (CHEBI:3077)
betamethasone phosphate (CHEBI:68603) has functional parent betamethasone (CHEBI:3077)
betamethasone valerate (CHEBI:31277) has functional parent betamethasone (CHEBI:3077)
IUPAC Name 
9-fluoro-11β,17,21-trihydroxy-16β-methylpregna-1,4-diene-3,20-dione
INNs  Source
betametasonaChEBI
betamethasoneChEBI
bétaméthasoneChEBI
betamethasonumChEBI
Synonyms  Source
16β-Methyl-1,4-pregnadiene-9α-fluoro-11β,17α,21-triol-3,20-dioneChemIDplus
9-Fluoro-16β-methylprednisoloneChemIDplus
9α-Fluoro-16β-methylprednisoloneChemIDplus
BetadexamethasoneChemIDplus
beta-Methasone alcoholChemIDplus
RinderonKEGG DRUG
Manual XrefsDatabases
1854VSDB
348DrugCentral
BetamethasoneWikipedia
D00244KEGG DRUG
DB00443DrugBank
US3053865Patent
US3104246Patent
Registry NumbersSources
Beilstein:3176546Beilstein
CAS:378-44-9NIST Chemistry WebBook
CAS:378-44-9ChemIDplus