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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H27O8P
Molecular Weight 438.408
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Prednisone Phosphate

SMILES

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

InChI

InChIKey=YVKDMGLKLAHTOR-ZPOLXVRWSA-N
InChI=1S/C21H27O8P/c1-19-7-5-13(22)9-12(19)3-4-14-15-6-8-21(25,17(24)11-29-30(26,27)28)20(15,2)10-16(23)18(14)19/h5,7,9,14-15,18,25H,3-4,6,8,10-11H2,1-2H3,(H2,26,27,28)/t14-,15-,18+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H27O8P
Molecular Weight 438.408
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 19:55:21 GMT 2023
Edited
by admin
on Sat Dec 16 19:55:21 GMT 2023
Record UNII
YY6F8K37SB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Prednisone Phosphate
Common Name English
Pregna-1,4-diene-3,11,20-trione, 17-hydroxy-21-(phosphonooxy)-
Systematic Name English
Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxy-, 21-phosphate
Systematic Name English
17-Hydroxy-21-Phosphonooxy-Pregna-1,4-Diene-3,11,20-Trione
Systematic Name English
Code System Code Type Description
PUBCHEM
9845968
Created by admin on Sat Dec 16 19:55:21 GMT 2023 , Edited by admin on Sat Dec 16 19:55:21 GMT 2023
PRIMARY
CAS
57099-40-8
Created by admin on Sat Dec 16 19:55:21 GMT 2023 , Edited by admin on Sat Dec 16 19:55:21 GMT 2023
PRIMARY
FDA UNII
YY6F8K37SB
Created by admin on Sat Dec 16 19:55:21 GMT 2023 , Edited by admin on Sat Dec 16 19:55:21 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT