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CHEBI:135815 - betamethasone butyrate propionate

ChEBI IDCHEBI:135815
ChEBI Namebetamethasone butyrate propionate
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC29H39FO7
Net Charge0
Average Mass518.622
Monoisotopic Mass518.26798
SMILES[H][C@@]12C[C@H](C)[C@](OC(=O)CCC)(C(=O)COC(=O)CC)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C29H39FO7/c1-6-8-25(35)37-29(23(33)16-36-24(34)7-2)17(3)13-21-20-10-9-18-14-19(31)11-12-26(18,4)28(20,30)22(32)15-27(21,29)5/h11-12,14,17,20-22,32H,6-10,13,15-16H2,1-5H3/t17-,20-,21-,22-,26-,27-,28-,29-/m0/s1
InChIKeyVXOWJCTXWVWLLC-REGDIAEZSA-N
Roles Classification
Biological Role:
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.
ChEBI Ontology
Outgoing Relation(s)
betamethasone butyrate propionate (CHEBI:135815) is a corticosteroid hormone (CHEBI:36699)
Synonym  Source
antebateDrugCentral
Manual XrefsDatabases
352DrugCentral
Registry NumbersSources
CAS:5534-02-1DrugCentral