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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H24O5
Molecular Weight 356.4123
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PREDNISONE-21-ALDEHYDE

SMILES

[H][C@@]12CC[C@](O)(C(=O)C=O)[C@@]1(C)CC(=O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=ZJGKMJHMOAPNRY-ZPOLXVRWSA-N
InChI=1S/C21H24O5/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/h5,7,9,11,14-15,18,26H,3-4,6,8,10H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H24O5
Molecular Weight 356.4123
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:41:11 GMT 2023
Edited
by admin
on Sat Dec 16 15:41:11 GMT 2023
Record UNII
P98T8D7BVX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PREDNISONE-21-ALDEHYDE
Common Name English
PREDNISONE IMPURITY C [EP IMPURITY]
Common Name English
PREGNA-1,4-DIEN-21-AL, 17-HYDROXY-3,11,20-TRIOXO-
Systematic Name English
17-HYDROXY-3,11,20-TRIOXOPREGNA-1,4-DIEN-21-AL
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40724571
Created by admin on Sat Dec 16 15:41:11 GMT 2023 , Edited by admin on Sat Dec 16 15:41:11 GMT 2023
PRIMARY
CAS
70522-55-3
Created by admin on Sat Dec 16 15:41:11 GMT 2023 , Edited by admin on Sat Dec 16 15:41:11 GMT 2023
PRIMARY
FDA UNII
P98T8D7BVX
Created by admin on Sat Dec 16 15:41:11 GMT 2023 , Edited by admin on Sat Dec 16 15:41:11 GMT 2023
PRIMARY
PUBCHEM
57369834
Created by admin on Sat Dec 16 15:41:11 GMT 2023 , Edited by admin on Sat Dec 16 15:41:11 GMT 2023
PRIMARY
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