CHEBI:68637 - dexamethasone phosphate

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ChEBI Name dexamethasone phosphate ChEBI ID CHEBI:68637 Definition A steroid phosphate that is the 21-O-phospho derivative of dexamethasone. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C22H30FO8P Net Charge 0 Average Mass 472.44100 Monoisotopic Mass 472.16623 InChI InChI=1S/C22H30FO8P/c1-12-8-16-15-5-4-13-9-14(24)6-7-19(13,2)21(15,23)17(25)10-20(16,3)22(12,27)18(26)11-31-32(28,29)30/h6-7,9,12,15-17,25,27H,4-5,8,10-11H2,1-3H3,(H2,28,29,30)/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1 InChIKey VQODGRNSFPNSQE-CXSFZGCWSA-N SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)COP(O)(O)=O)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C Roles Classification Biological Role(s): glucocorticoid receptor agonist An agonist that selectively binds to and activates a glucocorticoid receptor. View more via ChEBI Ontology ChEBI Ontology Outgoing dexamethasone phosphate (CHEBI:68637) has functional parent dexamethasone (CHEBI:41879) dexamethasone phosphate (CHEBI:68637) has role glucocorticoid receptor agonist (CHEBI:63562) dexamethasone phosphate (CHEBI:68637) is a 11β-hydroxy steroid (CHEBI:35346) dexamethasone phosphate (CHEBI:68637) is a 17-hydroxy steroid (CHEBI:36838) dexamethasone phosphate (CHEBI:68637) is a 3-oxo-Δ4 steroid (CHEBI:47909) dexamethasone phosphate (CHEBI:68637) is a fluorinated steroid (CHEBI:50830) dexamethasone phosphate (CHEBI:68637) is a steroid phosphate (CHEBI:36944) dexamethasone phosphate (CHEBI:68637) is a tertiary α-hydroxy ketone (CHEBI:139592) dexamethasone phosphate (CHEBI:68637) is conjugate acid of dexamethasone phosphate(2−) (CHEBI:68638) Incoming dexamethasone phosphate(2−) (CHEBI:68638) is conjugate base of dexamethasone phosphate (CHEBI:68637) IUPAC Name (11β,16α)-9-fluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl dihydrogen phosphate Synonyms Sources Betnelan phosphate ChemIDplus Dexamethasone 21-orthophosphate ChemIDplus Dexamethasone-21-dihydrogen-phosphate ChemIDplus Hexadrol phosphate ChemIDplus Neodecadron ChemIDplus Manual Xref Database 3920 DrugCentral View more database links Registry Numbers Types Sources 2230371 Reaxys Registry Number Reaxys 312-93-6 CAS Registry Number ChemIDplus Citations Types Sources 19910302 PubMed citation Europe PMC 20003498 PubMed citation Europe PMC 20642832 PubMed citation Europe PMC 21629568 PubMed citation Europe PMC 22115712 PubMed citation Europe PMC Last Modified 07 February 2018