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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28O6
Molecular Weight 376.4442
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 16.ALPHA.-HYDROXYPREDNISOLONE

SMILES

C[C@@]12C=CC(=O)C=C2CC[C@@]3([H])[C@]4([H])C[C@]([H])([C@](C(=O)CO)([C@@]4(C)C[C@@]([H])([C@@]31[H])O)O)O

InChI

InChIKey=SEKYBDYVXDAYPY-ILNISADRSA-N
InChI=1S/C21H28O6/c1-19-6-5-12(23)7-11(19)3-4-13-14-8-16(25)21(27,17(26)10-22)20(14,2)9-15(24)18(13)19/h5-7,13-16,18,22,24-25,27H,3-4,8-10H2,1-2H3/t13-,14-,15-,16+,18+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H28O6
Molecular Weight 376.4442
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 03:32:42 UTC 2021
Edited
by admin
on Sat Jun 26 03:32:42 UTC 2021
Record UNII
SW97540DC2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
16.ALPHA.-HYDROXYPREDNISOLONE
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 11,16,17,21-TETRAHYDROXY-, (11.BETA.,16.ALPHA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
SW97540DC2
Created by admin on Sat Jun 26 03:32:42 UTC 2021 , Edited by admin on Sat Jun 26 03:32:42 UTC 2021
PRIMARY
CAS
13951-70-7
Created by admin on Sat Jun 26 03:32:42 UTC 2021 , Edited by admin on Sat Jun 26 03:32:42 UTC 2021
PRIMARY
ECHA (EC/EINECS)
237-731-1
Created by admin on Sat Jun 26 03:32:42 UTC 2021 , Edited by admin on Sat Jun 26 03:32:42 UTC 2021
PRIMARY
PUBCHEM
11047056
Created by admin on Sat Jun 26 03:32:42 UTC 2021 , Edited by admin on Sat Jun 26 03:32:42 UTC 2021
PRIMARY
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