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CHEBI:31397 - Ciclesonide

Default Structure
ChEBI IDCHEBI:31397
ChEBI NameCiclesonide
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC32H44O7
Net Charge0
Average Mass540.697
Monoisotopic Mass540.30870
SMILES[H][C@@]12C[C@@]3([H])O[C@@H](C4CCCCC4)O[C@@]3(C(=O)COC(=O)C(C)C)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C32H44O7/c1-18(2)28(36)37-17-25(35)32-26(38-29(39-32)19-8-6-5-7-9-19)15-23-22-11-10-20-14-21(33)12-13-30(20,3)27(22)24(34)16-31(23,32)4/h12-14,18-19,22-24,26-27,29,34H,5-11,15-17H2,1-4H3/t22-,23-,24-,26+,27+,29+,30-,31-,32+/m0/s1
InChIKeyLUKZNWIVRBCLON-GXOBDPJESA-N
ChEBI Ontology
Outgoing Relation(s)
Ciclesonide (CHEBI:31397) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
alvescoDrugCentral
CiclesonideKEGG COMPOUND
omnarisDrugCentral
Manual XrefsDatabases
633DrugCentral
D01703KEGG DRUG
Registry NumbersSources
CAS:126544-47-6KEGG COMPOUND