cortisone

Chemical Formula:

C₂₁H₂₈O₅

Molecular Weight:

360.449 Daltons

Monoisotopic Mass:

360.19367400929997 Daltons

SMILES:

CC34([CH]2(C(=O)CC1(C)([CH](CCC(C(=O)CO)(O)1)[CH]2CCC3=CC(=O)CC4)))

InChI:

1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1

InChIKey:

MFYSYFVPBJMHGN-ZPOLXVRWSA-N

Synonyms

tetrahydrocortisone
adreson

Databases

MetaCyc: CORTISONE

RefMet: Cortisone

ChEBI: 16962

PubChem (CID): 222786

MetaboLights: MTBLC16962

ChemSpider: 454849

KEGG: C00762

CAS: 53-06-5

Reactome: 194035

Seed: cpd00566

HMDB: HMDB02802

MetaNetX: MNXM898