Chemical identity

Prednisolone EP Impurity F / 11-epi-Prednisolone

CAS 600-90-8 · C21H28O5

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-25882
PubChem CID12358724
NamePrednisolone EP Impurity F / 11-epi-Prednisolone
CAS RN600-90-8
Molecular formulaC21H28O5
Molecular weight360.44 g/mol
IUPAC name11α,17,21-Trihydroxypregna-1,4-diene-3,20-dione
InChIKeyOIGNJSKKLXVSLS-MKIDGPAKSA-N

02Structure identifiers

2D structurePubChem CID 12358724
2D structure: Prednisolone EP Impurity F / 11-epi-Prednisolone, CAS 600-90-8
Structure of Prednisolone EP Impurity F / 11-epi-Prednisolone (CAS 600-90-8). LazyChem record. Source identity: PubChem CID 12358724. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC21H28O5
InChIKeyOIGNJSKKLXVSLS-MKIDGPAKSA-N
Ring count4
Defined stereocentres7
Unassigned stereocentres0
SMILESC[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
InChIInChI=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

03Stereochemistry

The published structure contains 7 defined and 0 unassigned tetrahedral stereocentres. The exact wedge-and-dash depiction is shown above.

Defined stereocentres72D structure
Unassigned stereocentres02D structure
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 128Before symmetry reduction

Published same-connectivity configurations

2 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 600-90-8 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 600-90-8 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Prednisolone

View API and impurity family

Other names

  • Prednisolone EP Impurity F
  • Epiprednisolone
  • (8S,9S,10R,11R,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
  • 11-epi-Prednisolone

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources