CHEBI:177864 - Dexamethasone beloxil

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ChEBI Name Dexamethasone beloxil
ChEBI ID CHEBI:177864
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H35FO5
Net Charge 0
Average Mass 482.592
Monoisotopic Mass 482.24685
InChI InChI=1S/C29H35FO5/c1-18-13-23-22-10-9-20-14-21(31)11-12-26(20,2)28(22,30)24(32)15-27(23,3)29(18,34)25(33)17-35-16-19-7-5-4-6-8-19/h4-8,11-12,14,18,22-24,32,34H,9-10,13,15-17H2,1-3H3/t18-,22+,23+,24+,26+,27+,28+,29+/m1/s1
InChIKey FXEMVMUWTJUWJB-DKOUAETMSA-N
SMILES F[C@@]12[C@]([C@]3([C@@]([C@](O)([C@@H](C3)C)C(=O)COCC4=CC=CC=C4)(C[C@@H]1O)C)[H])(CCC=5[C@]2(C)C=CC(=O)C5)[H]
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in sausage (ENVO:00002166). See: MetaboLights Study
Roles Classification
Biological Role(s): 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.
(via steroid hormone )
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ChEBI Ontology
Outgoing Dexamethasone beloxil (CHEBI:177864) is a corticosteroid hormone (CHEBI:36699)
IUPAC Name
(8S,9R,10S,11S,13S,14S,16R,17R)-9-luoro-11,17-dihydroxy-10,13,16-trimethyl-17-(2-phenylmethoxyacetyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Manual Xrefs Databases
571094 ChemSpider
D02592 KEGG DRUG
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Registry Number Type Source
150587-07-8 CAS Registry Number ChemIDplus