CHEBI:34519 - 9alpha-Fluoro-6alpha-methylprednisolone 21-acetate

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ChEBI Name 9alpha-Fluoro-6alpha-methylprednisolone 21-acetate
ChEBI ID CHEBI:34519
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H31FO6
Net Charge 0
Average Mass 434.499
Monoisotopic Mass 434.21047
InChI InChI=1S/C24H31FO6/c1-13-9-18-16-6-8-23(30,20(29)12-31-14(2)26)22(16,4)11-19(28)24(18,25)21(3)7-5-15(27)10-17(13)21/h5,7,10,13,16,18-19,28,30H,6,8-9,11-12H2,1-4H3/t13-,16-,18-,19-,21-,22-,23-,24-/m0/s1
InChIKey KYVZRGYRHWSJFB-OOACPSMNSA-N
SMILES C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)COC(C)=O)[C@@]3(C)C[C@H](O)[C@]2(F)[C@@]2(C)C=CC(=O)C=C12
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 9alpha-Fluoro-6alpha-methylprednisolone 21-acetate (CHEBI:34519) is a corticosteroid hormone (CHEBI:36699)
Synonym Source
9alpha-Fluoro-6alpha-methylprednisolone 21-acetate KEGG COMPOUND
Manual Xref Database
C14625 KEGG COMPOUND
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Registry Number Type Source
432-33-7 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014