U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H30F2O6S
Molecular Weight 496.564
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZOTICASONE

SMILES

[H][C@@]12C[C@@H](C)[C@](O)(C(=O)S[C@@H]3CCOC3=O)[C@@]1(C)C[C@H](O)[C@@]4(F)[C@@]2([H])C[C@H](F)C5=CC(=O)C=C[C@]45C

InChI

InChIKey=OJRPWVDDBGJONP-PQUGYNIPSA-N
InChI=1S/C25H30F2O6S/c1-12-8-14-15-10-17(26)16-9-13(28)4-6-22(16,2)24(15,27)19(29)11-23(14,3)25(12,32)21(31)34-18-5-7-33-20(18)30/h4,6,9,12,14-15,17-19,29,32H,5,7-8,10-11H2,1-3H3/t12-,14+,15+,17+,18-,19+,22+,23+,24+,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H30F2O6S
Molecular Weight 496.564
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:19:10 GMT 2023
Edited
by admin
on Fri Dec 15 16:19:10 GMT 2023
Record UNII
W1M09KX30C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZOTICASONE
INN  
INN  
Official Name English
zoticasone [INN]
Common Name English
GR215864
Code English
ANDROSTA-1,4-DIENE-17-CARBOTHIOIC ACID, 6,9-DIFLUORO-11,17-DIHYDROXY-16-METHYL-3-OXO-, S-((3R)-TETRAHYDRO-2-OXO-3-FURANYL) ESTER, (6.ALPHA.,11.BETA.,16.ALPHA.,17.ALPHA.)-
Systematic Name English
GR-215864
Code English
S-((3R)-2-OXOTETRAHYDROFURAN-3-YL) 6.ALPHA.,9-DIFLUORO-12.BETA.,17-DIHYDROXY-16A-METHYL-3-OXOANDROSTA-1,4-DIENE-17.BETA.-CARBOTHIOATE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C521
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
Code System Code Type Description
ChEMBL
CHEMBL2105511
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
PRIMARY
FDA UNII
W1M09KX30C
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
PRIMARY
PUBCHEM
9983293
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
PRIMARY
CAS
678160-57-1
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
PRIMARY
NCI_THESAURUS
C66712
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
PRIMARY
SMS_ID
300000034484
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
PRIMARY
INN
8144
Created by admin on Fri Dec 15 16:19:10 GMT 2023 , Edited by admin on Fri Dec 15 16:19:10 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY