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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H36ClNO6
Molecular Weight 494.02
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-ACETAMIDO-21-CHLORO-11.BETA.,16.ALPHA.,17-TRIHYDROXYPREGN-4-ENE-3,20-DIONE-16,17-ACETONIDE

SMILES

[H][C@@]12C[C@H]3OC(C)(C)O[C@@]3(C(=O)CCl)[C@@]1(C)C[C@H](O)[C@@]4(NC(C)=O)[C@@]2([H])CCC5=CC(=O)CC[C@]45C

InChI

InChIKey=LITMZGQZIBURQO-VHDCPBDGSA-N
InChI=1S/C26H36ClNO6/c1-14(29)28-25-17(7-6-15-10-16(30)8-9-23(15,25)4)18-11-21-26(20(32)13-27,34-22(2,3)33-21)24(18,5)12-19(25)31/h10,17-19,21,31H,6-9,11-13H2,1-5H3,(H,28,29)/t17-,18-,19-,21+,23-,24-,25-,26+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
9-ACETAMIDO-21-CHLORO-11.BETA.,16.ALPHA.,17-TRIHYDROXYPREGN-4-ENE-3,20-DIONE-16,17-ACETONIDE
Common Name English
ACETAMIDE, N-((11.BETA.,16.ALPHA.)-21-CHLORO-11-HYDROXY-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-3,20-DIOXOPREGN-4-EN-9-YL)-
Systematic Name English
Code System Code Type Description
FDA UNII
EAB7J055DC
Created by admin on Fri Dec 15 15:31:00 GMT 2023 , Edited by admin on Fri Dec 15 15:31:00 GMT 2023
PRIMARY
PUBCHEM
90478605
Created by admin on Fri Dec 15 15:31:00 GMT 2023 , Edited by admin on Fri Dec 15 15:31:00 GMT 2023
PRIMARY
CAS
52091-97-1
Created by admin on Fri Dec 15 15:31:00 GMT 2023 , Edited by admin on Fri Dec 15 15:31:00 GMT 2023
PRIMARY