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Details

Stereochemistry EPIMERIC
Molecular Formula C25H34O6
Molecular Weight 430.5339
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of D-HOMOBUDESONIDE

SMILES

[H][C@@]12CCC3=CC(=O)C=C[C@]3(C)[C@@]1([H])[C@@H](O)C[C@]4(C)C(=O)[C@]5(CO)OC(CCC)O[C@@H]5C[C@@]24[H]

InChI

InChIKey=DRLZLIQUOCVRLM-PINIVEOHSA-N
InChI=1S/C25H34O6/c1-4-5-20-30-19-11-17-16-7-6-14-10-15(27)8-9-23(14,2)21(16)18(28)12-24(17,3)22(29)25(19,13-26)31-20/h8-10,16-21,26,28H,4-7,11-13H2,1-3H3/t16-,17-,18-,19+,20?,21+,23-,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H34O6
Molecular Weight 430.5339
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 8 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:34:44 UTC 2023
Edited
by admin
on Thu Jul 06 23:34:44 UTC 2023
Record UNII
7BYQ3VT7JN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
D-HOMOBUDESONIDE
Common Name English
16.ALPHA.,17-((1RS)-BUTYLIDENEBIS(OXY))-11.BETA.-HYDROXY-17-(HYDROXYMETHYL)-D-HOMOANDROSTA-1,4-DIENE-3,17A-DIONE
Systematic Name English
BUDESONIDE IMPURITY C [EP IMPURITY]
Common Name English
BUDESONIDE D-HOMO ANALOG [USP IMPURITY]
Common Name English
CHRYSENO(2,3-D)(1,3)DIOXOLE-2,7(4AH,5H)-DIONE, 4B,6,6A,7A,10A,11,11A,11B,12,13-DECAHYDRO-5-HYDROXY-7A-(HYDROXYMETHYL)-4A,6A-DIMETHYL-9-PROPYL-, (4AR,4BS,5S,6AS,7AR,10AR,11AS,11BS)-
Systematic Name English
Code System Code Type Description
RS_ITEM_NUM
1A00500
Created by admin on Thu Jul 06 23:34:44 UTC 2023 , Edited by admin on Thu Jul 06 23:34:44 UTC 2023
PRIMARY
FDA UNII
7BYQ3VT7JN
Created by admin on Thu Jul 06 23:34:44 UTC 2023 , Edited by admin on Thu Jul 06 23:34:44 UTC 2023
PRIMARY
PUBCHEM
118989637
Created by admin on Thu Jul 06 23:34:44 UTC 2023 , Edited by admin on Thu Jul 06 23:34:44 UTC 2023
PRIMARY
CAS
1040085-99-1
Created by admin on Thu Jul 06 23:34:44 UTC 2023 , Edited by admin on Thu Jul 06 23:34:44 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
This impurity is to be reported under total unspecified impurities. Do not report it under total specified impurities.
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP