Prednisolone
PubChem CID: 5755
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| Compound Synonyms | prednisolone, 50-24-8, Metacortandralone, Hydroretrocortine, Delta-Cortef, Deltacortril, Deltahydrocortisone, Codelcortone, Cortalone, Meticortelone, Predonine, Prenolone, Hydroretrocortin, Meti-Derm, Deltacortenol, Hydrodeltalone, Hydrodeltisone, Precortancyl, Predniliderm, Cotogesic, Decaprednil, Delcortol, Deltisilone, Dicortol, Donisolone, Dydeltrone, Erbacort, Erbasona, Estilsona, Fernisolone, Hydeltra, Hydeltrone, Lentosone, Paracortol, Paracotol, PRDL, Precortilon, Precortisyl, Prednelan, Prednicen, Predonin, Rolisone, Scherisolon, Sterolone, Cordrol, Prednis, Prelone, Steran, Sterane, Ulacort, Delta-stab, Fernisolone P, Hostacortin H, Ultracorten H, Ultracortene-H, Predne-Dome, Decortin H, CO-Hydeltra, Eazolin D, Di-adreson F, Delta F, Derpo PD, Solone, 1-Dehydrohydrocortisone, Fernisolone-P, delta(1)-Hydrocortisone, delta(1)-Dehydrocortisol, Delta-Ef-Cortelan, Predniretard, Prednisolona, Dexa-Cortidelt hostacortin H, Panafcortelone, Prednisolonum, Cotolone, 1,2-Dehydrohydrocortisone, delta(1)-Cortisol, Deltasolone, Supercortisol, Klismacort, Prednisolonum [INN-Latin], Prednisolona [INN-Spanish], Bubbli-Pred, delta(sup 1)-Cortisol, Delta(1)-dehydrohydrocortisone, 1,4-Pregnadiene-11beta,17alpha,21-triol-3,20-dione, Ultracortene-hydrogen, 11beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione, delta(sup 1)-Hydrocortisone, delta(sup 1)-Dehydrocortisol, CCRIS 980, (11beta)-11,17,21-Trihydroxypregna-1,4-diene-3,20-dione, 1,4-Pregnadiene-3,20-dione-11beta,17alpha,21-triol, K 1557, HSDB 3385, UNII-9PHQ9Y1OLM, 3,20-Dioxo-11beta,17alpha,21-trihydroxy-1,4-pregnadiene, 9PHQ9Y1OLM, delta(sup 1)-Dehydrohydrocortisone, NSC 9120, NSC-9120, NSC-9900, EINECS 200-021-7, delta-hydrocortisone, MFCD00003649, 11beta,17alpha,21-Trihydroxypregna-1,4-diene-3,20-dione, delta-dehydrocortisol, DELTA.1-Cortisol, APREDNISLON, BRN 1354103, EQUISOLON, VETSOLONE, CHEBI:8378, (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one, DTXSID9021184, .DELTA.1-Cortisol, Prednisolone (Standard), delta-dehydrohydrocortisone, (+)-PREDNISOLONE, .DELTA.1-Hydrocortisone, .DELTA.1-Dehydrocortisol, CHEMBL131, PREDNISOLONE ANHYDROUS, DTXCID301184, .DELTA.1-Dehydrohydrocortisone, .delta.-Cortef, 1-Dehydrocortisol, Neo-Delta-Cortef, NSC9120, EC 200-021-7, .delta.-Stab, 4-08-00-03467 (Beilstein Handbook Reference), component of Ataraxoid, PREDNISOLONE (EMA EPAR: VETERINARY), Prednisolonum (INN-Latin), component of K-Predne-Dome, Prednisolona (INN-Spanish), PREDNISOLONE (MART.), PREDNISOLONE [MART.], CHLOROPTIC-P S.O.P. COMPONENT PREDNISOLONE, PREDNISOLONE (USP-RS), PREDNISOLONE [USP-RS], PREDNISOLONE (EP MONOGRAPH), PREDNISOLONE [EP MONOGRAPH], PREDNISOLONE (USP MONOGRAPH), PREDNISOLONE [USP MONOGRAPH], Prednisolone (1.0 mg/mL in Methanol), SMR000718761, Prednisolone [INN:BAN:JAN], PREDNICARBATE IMPURITY A (EP IMPURITY), PREDNICARBATE IMPURITY A [EP IMPURITY], HYDROCORTISONE IMPURITY A (EP IMPURITY), HYDROCORTISONE IMPURITY A [EP IMPURITY], METHYLPREDNISOLONE IMPURITY K (EP IMPURITY), METHYLPREDNISOLONE IMPURITY K [EP IMPURITY], MLS002638110, Pregna-1,20-dione, 11.beta.,17,21-trihydroxy-, Predisolone Sodium Phosphate, prednisolon, Adnisolone, Deltidrosol, Kuhlprednon, Lenisolone, Longiprednil, Predeltilone, Prednicortelone, Capsoid, Dhasolone, Fisopred, Frisolona, Gupisone, Opredsone, Preflam, Prenilone, Pregna-1,20-dione, 11,17,21-trihydroxy-, (11.beta.)-, PrednisTab, Delta-Phoricol, Lepi-Cortinolo, Dontisolon D, Predni-Coelin, Dacortin H, Delta-Diona, Pred-Clysma, Predni-Helvacort, Prednisolone oral, Meti Derm, Delta-F, CAS-50-24-8, Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-, (11beta)-, Linola-H-Fett N, NCGC00094764-01, Prednisolone Powder, Linola-H N, TUA, Prestwick_404, delta1-Hydrocortisone, Delta-Cortef (TN), 11-beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione, T-Pred (Salt/Mix), 1,4-Pregnadien-11-beta,17-alpha,21-triol-3,20-dione, 1,4-Pregnadiene-11-beta,17-alpha,21-triol-3,20-dione, 1,4-Pregnadiene-3,20-dione-11-beta,17-alpha,21-triol, Delta(1)Hydrocortisone, Pregna-1,4-diene-3,20-dione, 11beta,17,21-trihydroxy-, Prednisolone, >=99%, Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-, (11b)-, Prestwick0_000274, Prestwick1_000274, Prestwick2_000274, Prestwick3_000274, PREDNISOLONE [EP], PREDNISOLONE [MI], PREDNISOLONE [INN], PREDNISOLONE [JAN], PREDNISOLONE [HSDB], SCHEMBL3233, K-Predne-Dome (Salt/Mix), PREDNISOLONE [VANDF], PREDNISONE IMPURITY B, .DELTA.(sup 1)-Cortisol, BSPBio_000148, Delta1-dehydro-hydrocortisone, (1S,2R,10S,11S,14R,15S,17S)-14,17-dihydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-dien-5-one, MLS001304083, MLS002154250, MLS002207037, MLS002548883, PREDNISOLONE [WHO-DD], PREDNISOLONE [WHO-IP], SPBio_002367, BPBio1_000164, GTPL2866, US10196374, Prednisolone, Prednisolone anhydrous Micronized, .DELTA.(sup 1)-Hydrocortisone, BDBM19190, Prednisolone (JP17/USP/INN), NSC9900, PREDNISOLONE [GREEN BOOK], .DELTA.(sup 1)-Dehydrocortisol, HMS1568H10, HMS2090J05, HMS2095H10, HMS2230P10, HMS3259E09, HMS3712H10, PREDNISOLONE [ORANGE BOOK], PREDNISONE IMPURITY B [EP], BCP09053, Tox21_111327, Tox21_201673, Tox21_302987, HY-17463R, LMST02030179, PREDNISOLONUM [WHO-IP LATIN], Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-, (11.beta.)-, s1737, .DELTA.(sup 1)-Dehydrohydrocortisone, AKOS015894935, Tox21_111327_1, AC-1773, CCG-220274, DB00860, FP27131, NC00473, NCGC00179649-01, NCGC00179649-02, NCGC00179649-03, NCGC00179649-04, NCGC00179649-06, NCGC00256577-01, NCGC00259222-01, (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one, AS-13665, HY-17463, CS-0695025, NS00000394, P0637, EN300-53017, C07369, D00472, D91990, Prednisolone, VETRANAL(TM), analytical standard, SR-01000837502, SR-01000837502-2, BRD-K98039984-001-03-0, BRD-K98039984-001-06-3, PREDNISOLONE ACETATE IMPURITY B [EP IMPURITY], PREDNISOLONE COMPONENT OF CHLOROPTIC-P S.O.P., Q11426176, 11beta,17,21-trihydroxy-1,4-pregnadiene-3,20-dione, Prednisolone, British Pharmacopoeia (BP) Assay Standard, Z778141968, 11-.beta.,17,21-Trihydroxypregna-1,4-diene-3,20-dione, 11beta,17alpha,21-Trihydroxy-1,4-pregnadiene-3,20-dione, 1,4-Pregnadien-11-.beta.,17-.alpha.,21-triol-3,20-dione, 1,4-Pregnadiene-11-.beta.,17-.alpha.,21-triol-3,20-dione, 1,4-Pregnadiene-3,20-dione-11-.beta.,17-.alpha.,21-triol, Prednisolone, European Pharmacopoeia (EP) Reference Standard, Pregna-1,4-diene-3,20-dione, 11.beta.,17,21-trihydroxy-, 11,17,21-Trihydroxypregna-1,4-diene-3,20-dione, (11.beta.)-, 11-.beta.,17-.alpha.,21-Trihydroxy-1,4-pregnadiene-3,20-dione, 11-.beta.,17-.alpha.,21-Trihydroxypregna-1,4-diene-3,20-dione, 11.BETA.,17,21-TRIHYDROXYPREGNA-1,4-DIENE-3,20-DIONE., 11.beta.,17.alpha.,21-Trihydroxypregna-1,4-diene-3,20-dione, Prednisolone, United States Pharmacopeia (USP) Reference Standard, (11?)-11,17,21-Trihydroxy-pregna-1,4-diene-3,20-dione, Metacortandralone, Delta F, Prednisolone for peak identification, European Pharmacopoeia (EP) Reference Standard, Prednisolone for system suitability, European Pharmacopoeia (EP) Reference Standard, Prednisolone, Pharmaceutical Secondary Standard, Certified Reference Material, PREGNA-1,4-DIENE-3,20-DIONE, 11,17,21-TRIHYDROXY-, (11.BETA)-, (1R,3aS,3bS,9aR,9bS,10S,11aS)-1,10-dihydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one, 200-021-7, 8056-11-9 |
|---|---|
| Prediction Swissadme | 1.0 |
| Topological Polar Surface Area | 94.8 |
| Hydrogen Bond Donor Count | 3.0 |
| Inchi Key | OIGNJSKKLXVSLS-VWUMJDOOSA-N |
| Fcsp3 | 0.7142857142857143 |
| Rotatable Bond Count | 2.0 |
| Heavy Atom Count | 26.0 |
| Compound Name | Prednisolone |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 360.194 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 360.194 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 724.0 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 360.4 |
| Database Name | cmaup_ingredients;pubchem |
| Covalent Unit Count | 1.0 |
| Defined Atom Stereocenter Count | 7.0 |
| Iupac Name | (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one |
| Total Atom Stereocenter Count | 7.0 |
| Total Bond Stereocenter Count | 0.0 |
| Prediction Hob | 1.0 |
| Esol | -2.9633900000000004 |
| Inchi | 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/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1 |
| Smiles | C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C)O |
| Target Id | NPT249, NPT153, NPT894, NPT541, NPT745, NPT542, NPT713 |
| Xlogp | 1.6 |
| Defined Bond Stereocenter Count | 0.0 |
| Molecular Formula | C21H28O5 |
- 1. Outgoing r'ship
FOUND_INto/from Ferula Kuhistanica (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Phytolacca Acinosa (Plant) Rel Props:Source_db:cmaup_ingredients