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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H31NO3
Molecular Weight 357.4864
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,20-Dioxo-17?-pregn-4-ene-16?-carboxamide

SMILES

CC(=O)[C@@H]1[C@H](C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(N)=O

InChI

InChIKey=PUEBYNKQSZOEQP-GIPCDWCDSA-N
InChI=1S/C22H31NO3/c1-12(24)19-16(20(23)26)11-18-15-5-4-13-10-14(25)6-8-21(13,2)17(15)7-9-22(18,19)3/h10,15-19H,4-9,11H2,1-3H3,(H2,23,26)/t15-,16+,17+,18+,19-,21+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H31NO3
Molecular Weight 357.4864
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:18:21 GMT 2025
Edited
by admin
on Mon Mar 31 22:18:21 GMT 2025
Record UNII
CC83E2NPD4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
16-?-Carboxamide-(17-?)-isoprogesterone
Preferred Name English
3,20-Dioxo-17?-pregn-4-ene-16?-carboxamide
Systematic Name English
17?-Pregn-4-ene-16?-carboxamide, 3,20-dioxo-
Systematic Name English
Code System Code Type Description
PUBCHEM
200250
Created by admin on Mon Mar 31 22:18:21 GMT 2025 , Edited by admin on Mon Mar 31 22:18:21 GMT 2025
PRIMARY
CAS
1434-68-0
Created by admin on Mon Mar 31 22:18:21 GMT 2025 , Edited by admin on Mon Mar 31 22:18:21 GMT 2025
PRIMARY
FDA UNII
CC83E2NPD4
Created by admin on Mon Mar 31 22:18:21 GMT 2025 , Edited by admin on Mon Mar 31 22:18:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID00931865
Created by admin on Mon Mar 31 22:18:21 GMT 2025 , Edited by admin on Mon Mar 31 22:18:21 GMT 2025
PRIMARY