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prednisone

PropertiesImage
MNX_IDMNXM21138 Image of MNXM21138
referencechebi:8382
formulaC21H26O5
global charge0
mol weight358.434
InChIKeyXOFYZVNMUHMLCC-ZPOLXVRWSA-N
InChIInChI=1S/C21H26O5/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/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1
SMILESC[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO
MNX internals
InChI (mnx)InChI=1/C21H26O5/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/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1 Image of MNXM21138
SMILES (mnx)[CH3:1][C@:19]12[CH:7]=[CH:5][C:13](=[O:23])[CH:9]=[C:12]1[CH2:3][CH2:4][C@H:14]1[C@@H:15]3[CH2:6][CH2:8][C@@:21]([C:17]([CH2:11][OH:22])=[O:25])([OH:26])[C@@:20]3([CH3:2])[CH2:10][C:16](=[O:24])[C@@H:18]12
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:8382
chebi:8382
XOFYZVNMUHMLCC-ZPOLXVRWSA-N 		prednisone
1,2-Dehydrocortisone
1,4-Pregnadiene-17alpha,21-diol-3,11,20-trione
17,21-Dihydroxypregna-1,4-diene-3,11,20-trione
17,21-dihydroxypregna-1,4-diene-3,11,20-trione
Dehydrocortisone
prednison
prednisona
prednisonum

seed.compound:cpd04568
seedM:cpd04568
vmhM:prdns
vmhM:prdns
vmhmetabolite:prdns
vmhmetabolite:prdns
XOFYZVNMUHMLCC-ZPOLXVRWSA-N 		Prednisone
hmdb:HMDB0014773
XOFYZVNMUHMLCC-ZPOLXVRWSA-N 		Prednisone
(1S,2R,10S,11S,14R,15S)-14-hydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-diene-5,17-dione
1,2-Dehydrocortisone
1,4-Pregnadiene-17a,21-diol-3,11,20-trione
1,4-Pregnadiene-17alpha,21-diol-3,11,20-trione
17,21-Dihydroxypregna-1,4-diene-3,11,20-trione
Acis brand OF prednisone
Acsis, prednison
Apo-prednisone
Apotex brand OF prednisone
Aventis brand OF prednisone
Cortan
Cortancyl
Cutason
Dacortin
Decortin
Decortisyl
Dehydrocortisone
Deltasone
Diba brand OF prednisone
Encorton
Encortone
Enkortolon
Fawns and mcallan brand OF prednisone
Ferring brand OF prednisone
GALENpharma brand OF prednisone
Halsey drug brand OF prednisone
Hexal brand OF prednisone
Hoechst brand OF prednisone
ICN brand OF prednisone
Kortancyl
Lichtenstein brand OF prednisone
Liquid pred
Merck brand OF prednisone
Merz brand OF prednisone
Meticorten
Mibe brand OF prednisone
Orasone
Panafcort
Panasol
Pharmacia brand OF prednisone
Predni tablinen
Prednidib
Predniment
Prednison
Prednison acsis
Prednison galen
Prednison hexal
Prednisona
Prednisonum
Pronisone
Rectodelt
Schering-plough brand OF prednisone
Seatrace brand OF prednisone
Solvay brand OF prednisone
Sone
Sterapred
Trommsdorff brand OF prednisone
Ultracorten
Winpred
delta-Cortisone
prednisone

kegg.compound:C07370
keggC:C07370
XOFYZVNMUHMLCC-ZPOLXVRWSA-N 		Prednisone
1,2-Dehydrocortisone
17,21-Dihydroxypregna-1,4-diene-3,11,20-trione

metacyc.compound:CPD-22917
metacycM:CPD-22917
XOFYZVNMUHMLCC-ZPOLXVRWSA-N 		prednisone

lipidmaps:LMST02030180
lipidmapsM:LMST02030180
XOFYZVNMUHMLCC-ZPOLXVRWSA-N 		prednisone
1,2-Dehydrocortisone
1,4-Pregnadiene-17alpha,21-diol-3,11,20-trione
17,21-Dihydroxypregna-1,4-diene-3,11,20-trione
17,21-dihydroxypregna-1,4-diene-3,11,20-trione
O5
Prednisone
ST 21:5

hmdb:HMDB14773
keggC:M_C07370
seedM:M_cpd04568
vmhM:M_prdns 		secondary/obsolete/fantasy identifier