CHEBI:3078 - betamethasone sodium phosphate

ChEBI IDCHEBI:3078
ChEBI Namebetamethasone sodium phosphate
Stars
DefinitionAn organic sodium salt that is the disodium salt of betamethasone phosphate.
Last Modified7 February 2018
DownloadsMolfile
FormulaC22H28FO8P.2Na
Net Charge0
Average Mass516.410
Monoisotopic Mass516.13012
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@@]21C.[Na+].[Na+]
InChIInChI=1S/C22H30FO8P.2Na/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);;/q;2*+1/p-2/t12-,15-,16-,17-,19-,20-,21-,22-;;/m0../s1
InChIKeyPLCQGRYPOISRTQ-LWCNAHDDSA-L
Roles Classification
Biological Role:
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
Applications:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
ophthalmology drug  Any compound used for the treatment of eye conditions or eye diseases.
ChEBI Ontology
Outgoing Relation(s)
betamethasone sodium phosphate (CHEBI:3078) has part betamethasone phosphate(2−) (CHEBI:68604)
betamethasone sodium phosphate (CHEBI:3078) has role analgesic (CHEBI:35480)
betamethasone sodium phosphate (CHEBI:3078) has role anti-inflammatory agent (CHEBI:67079)
betamethasone sodium phosphate (CHEBI:3078) has role ophthalmology drug (CHEBI:66981)
betamethasone sodium phosphate (CHEBI:3078) is a organic sodium salt (CHEBI:38700)
betamethasone sodium phosphate (CHEBI:3078) is a tertiary α-hydroxy ketone (CHEBI:139592)
IUPAC Name 
disodium 9-fluoro-11β,17-dihydroxy-16β-methyl-3,20-dioxopregna-1,4-dien-21-yl phosphate
Synonyms  Source
9-Fluoro-11β,17,21-trihydroxy-16β-methylpregna-1,4-diene-3,20-dione 21-(disodium phosphate)ChemIDplus
Betamethasone 21-disodium phosphateChemIDplus
Betamethasone 21-phosphate disodium saltChEMBL
Betamethazone disodium phosphateChemIDplus
NSC-90616ChEMBL
Brand Names  Source
Betamethasone sodium phosphate component of celestone soluspanChEMBL
Betam-ophtalChEMBL
Betnesol-nChEMBL
VistamethasoneChEMBL
Vistamethasone nChEMBL
Manual XrefsDatabases
D00972KEGG DRUG
DB00443DrugBank
Registry NumbersSources
CAS:151-73-5ChemIDplus