CHEBI:4463 - Dexamethasone acetate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Dexamethasone acetate
ChEBI ID CHEBI:4463
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H31FO6
Net Charge 0
Average Mass 434.499
Monoisotopic Mass 434.21047
InChI InChI=1S/C24H31FO6/c1-13-9-18-17-6-5-15-10-16(27)7-8-21(15,3)23(17,25)19(28)11-22(18,4)24(13,30)20(29)12-31-14(2)26/h7-8,10,13,17-19,28,30H,5-6,9,11-12H2,1-4H3/t13-,17+,18+,19+,21+,22+,23+,24+/m1/s1
InChIKey AKUJBENLRBOFTD-RPRRAYFGSA-N
SMILES C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(C)=O
Roles Classification
Biological Role(s): 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.
(via steroid hormone )
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ChEBI Ontology
Outgoing Dexamethasone acetate (CHEBI:4463) is a corticosteroid hormone (CHEBI:36699)
Synonyms Sources
decadronal DrugCentral
Dexamethasone acetate anhydrous KEGG COMPOUND
neofordex DrugCentral
Manual Xrefs Databases
826 DrugCentral
C08174 KEGG COMPOUND
D07796 KEGG DRUG
View more database links
Registry Number Type Source
1177-87-3 CAS Registry Number KEGG COMPOUND
Last Modified
22 February 2017