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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H30Cl2O6
Molecular Weight 497.408
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 21-(ACETYLOXY)-9,11-DICHLORO-16,17-(1,2-ETHANEDIYLBIS(OXY))PREGNA-1,4-DIENE-3,20-DIONE, (11.BETA.,16.ALPHA.)-

SMILES

CC(=O)OCC(=O)[C@@]12OCCO[C@@H]1C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(Cl)[C@@H](Cl)C[C@]23C

InChI

InChIKey=JPMFTHQXLMPMLI-RBWIMXSLSA-N
InChI=1S/C25H30Cl2O6/c1-14(28)32-13-20(30)25-21(31-8-9-33-25)11-18-17-5-4-15-10-16(29)6-7-22(15,2)24(17,27)19(26)12-23(18,25)3/h6-7,10,17-19,21H,4-5,8-9,11-13H2,1-3H3/t17-,18-,19-,21+,22-,23-,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H30Cl2O6
Molecular Weight 497.408
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 21:28:08 GMT 2025
Edited
by admin
on Mon Mar 31 21:28:08 GMT 2025
Record UNII
Y0AZ19YP37
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PREGNA-1,4-DIENE-3,20-DIONE, 21-(ACETYLOXY)-9,11-DICHLORO-16,17-(1,2-ETHANEDIYLBIS(OXY))-, (11.BETA.,16.ALPHA.)-
Preferred Name English
21-(ACETYLOXY)-9,11-DICHLORO-16,17-(1,2-ETHANEDIYLBIS(OXY))PREGNA-1,4-DIENE-3,20-DIONE, (11.BETA.,16.ALPHA.)-
Common Name English
Code System Code Type Description
FDA UNII
Y0AZ19YP37
Created by admin on Mon Mar 31 21:28:08 GMT 2025 , Edited by admin on Mon Mar 31 21:28:08 GMT 2025
PRIMARY
CAS
60008-83-5
Created by admin on Mon Mar 31 21:28:08 GMT 2025 , Edited by admin on Mon Mar 31 21:28:08 GMT 2025
PRIMARY
PUBCHEM
86278203
Created by admin on Mon Mar 31 21:28:08 GMT 2025 , Edited by admin on Mon Mar 31 21:28:08 GMT 2025
PRIMARY