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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H41FO8
Molecular Weight 560.6508
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BETAMETHASONE 11,17,21-TRIPROPIONATE

SMILES

CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@H](C[C@]12C)OC(=O)CC

InChI

InChIKey=MWHBGLRGUXAGHT-DGBYXFBUSA-N
InChI=1S/C31H41FO8/c1-7-25(35)38-17-23(34)31(40-27(37)9-3)18(4)14-22-21-11-10-19-15-20(33)12-13-28(19,5)30(21,32)24(16-29(22,31)6)39-26(36)8-2/h12-13,15,18,21-22,24H,7-11,14,16-17H2,1-6H3/t18-,21-,22-,24-,28-,29-,30-,31-/m0/s1

HIDE SMILES / InChI

Molecular Formula C31H41FO8
Molecular Weight 560.6508
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:12:53 GMT 2025
Edited
by admin
on Mon Mar 31 22:12:53 GMT 2025
Record UNII
BE608TNS5G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BETAMETHASONE 11,17,21-TRIPROPIONATE
Common Name English
BETAMETHASONE DIPROPIONATE IMPURITY G
Preferred Name English
BETAMETHASONE TRIPROPIONATE
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-16-METHYL-11,17,21-TRIS(1-OXOPROPOXY)-, (11.BETA.,16.BETA.)-
Common Name English
9-FLUORO-16.BETA.-METHYL-3,20-DIOXOPREGNA-1,4-DIENE-11.BETA.,17,21-TRIYL TRIPROPANOATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID90737999
Created by admin on Mon Mar 31 22:12:53 GMT 2025 , Edited by admin on Mon Mar 31 22:12:53 GMT 2025
PRIMARY
CAS
1186048-33-8
Created by admin on Mon Mar 31 22:12:53 GMT 2025 , Edited by admin on Mon Mar 31 22:12:53 GMT 2025
PRIMARY
PUBCHEM
68122919
Created by admin on Mon Mar 31 22:12:53 GMT 2025 , Edited by admin on Mon Mar 31 22:12:53 GMT 2025
PRIMARY
SMS_ID
300000053195
Created by admin on Mon Mar 31 22:12:53 GMT 2025 , Edited by admin on Mon Mar 31 22:12:53 GMT 2025
PRIMARY
FDA UNII
BE608TNS5G
Created by admin on Mon Mar 31 22:12:53 GMT 2025 , Edited by admin on Mon Mar 31 22:12:53 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY