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

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H28Cl2O5
Molecular Weight 455.371
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICHLORISONE ACETATE

SMILES

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

InChI

InChIKey=YNNURTVKPVJVEI-GSLJADNHSA-N
InChI=1S/C23H28Cl2O5/c1-13(26)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(27)6-8-20(14,2)23(17,25)18(24)11-21(16,22)3/h6,8,10,16-18,29H,4-5,7,9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H28Cl2O5
Molecular Weight 455.371
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Simultaneous analysis of twenty-one glucocorticoids in equine plasma by liquid chromatography/tandem mass spectrometry.
2005
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:13:49 GMT 2023
Edited
by admin
on Fri Dec 15 19:13:49 GMT 2023
Record UNII
64FTA4579H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICHLORISONE ACETATE
MART.   WHO-DD  
Common Name English
DICHLORISONE ACETATE [MART.]
Common Name English
DICHLORISONE 21-ACETATE [MI]
Common Name English
Dichlorisone acetate [WHO-DD]
Common Name English
9.ALPHA.,11.BETA.-DICHLORO-17.ALPHA.,21-DIHYDROXYPREGNA-1,4-DIENE-3,20-DIONE 21-ACETATE
Systematic Name English
NSC-759246
Code English
DICHLORISONE 21-ACETATE
MI  
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
201-213-3
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY
ChEMBL
CHEMBL1385514
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY
CAS
79-61-8
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY
PUBCHEM
5388959
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY
MERCK INDEX
m4327
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY Merck Index
MESH
C020282
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID401000180
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY
NSC
759246
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY
FDA UNII
64FTA4579H
Created by admin on Fri Dec 15 19:13:49 GMT 2023 , Edited by admin on Fri Dec 15 19:13:49 GMT 2023
PRIMARY