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CHEBI:31484 - Diflucortolone valerate

ChEBI IDCHEBI:31484
ChEBI NameDiflucortolone valerate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC27H36F2O5
Net Charge0
Average Mass478.576
Monoisotopic Mass478.25308
SMILES[H][C@@]12C[C@H](F)C3=CC(=O)C=C[C@]3(C)[C@@]1(F)[C@@H](O)C[C@]1(C)[C@@H](C(=O)COC(=O)CCCC)[C@H](C)C[C@@]21[H]
InChIInChI=1S/C27H36F2O5/c1-5-6-7-23(33)34-14-21(31)24-15(2)10-17-18-12-20(28)19-11-16(30)8-9-26(19,4)27(18,29)22(32)13-25(17,24)3/h8-9,11,15,17-18,20,22,24,32H,5-7,10,12-14H2,1-4H3/t15-,17+,18+,20+,22+,24-,25+,26+,27+/m1/s1
InChIKeyHHJIUUAMYGBVSD-YTFFSALGSA-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)
Diflucortolone valerate (CHEBI:31484) is a corticosteroid hormone (CHEBI:36699)
Synonym  Source
Diflucortolone valerateKEGG COMPOUND
Manual XrefsDatabases
D01764KEGG DRUG
Registry NumbersSources
CAS:59198-70-8KEGG COMPOUND