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Details

Stereochemistry EPIMERIC
Molecular Formula C25H32O6
Molecular Weight 428.5189
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .DELTA.6-BUDESONIDE

SMILES

CCCC1([H])O[C@]2([H])C[C@@]3([H])[C@]4([H])C=CC5=CC(=O)C=C[C@]5(C)[C@@]4([H])[C@]([H])(C[C@]3(C)[C@]2(C(=O)CO)O1)O

InChI

InChIKey=OFBFHEDLHIWDQX-KWVAZRHASA-N
InChI=1S/C25H32O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h6-10,16-18,20-22,26,28H,4-5,11-13H2,1-3H3/t16-,17-,18-,20+,21?,22+,23-,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H32O6
Molecular Weight 428.5189
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 7 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 06:48:05 UTC 2021
Edited
by admin
on Sat Jun 26 06:48:05 UTC 2021
Record UNII
LSP9K19F7R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.DELTA.6-BUDESONIDE
Common Name English
PREGNA-1,4,6-TRIENE-3,20-DIONE, 16,17-(BUTYLIDENEBIS(OXY))-11,21-DIHYDROXY-, (11.BETA.,16.ALPHA.)-
Systematic Name English
Code System Code Type Description
PUBCHEM
91810598
Created by admin on Sat Jun 26 06:48:05 UTC 2021 , Edited by admin on Sat Jun 26 06:48:05 UTC 2021
PRIMARY
CAS
109458-75-5
Created by admin on Sat Jun 26 06:48:05 UTC 2021 , Edited by admin on Sat Jun 26 06:48:05 UTC 2021
PRIMARY
FDA UNII
LSP9K19F7R
Created by admin on Sat Jun 26 06:48:05 UTC 2021 , Edited by admin on Sat Jun 26 06:48:05 UTC 2021
PRIMARY
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