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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H31NO2
Molecular Weight 329.4763
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Progesterone 3-oxime, (3E)-

SMILES

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

InChI

InChIKey=FPSIMALNSFTZTF-MJRGJNICSA-N
InChI=1S/C21H31NO2/c1-13(23)17-6-7-18-16-5-4-14-12-15(22-24)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19,24H,4-11H2,1-3H3/b22-15+/t16-,17+,18-,19-,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H31NO2
Molecular Weight 329.4763
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:30:19 GMT 2023
Edited
by admin
on Sat Dec 16 19:30:19 GMT 2023
Record UNII
F8T9WRY9YH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Progesterone 3-oxime, (3E)-
Common Name English
(3E)-Pregn-4-ene-3,20-dione 3-oxime
Systematic Name English
Code System Code Type Description
FDA UNII
F8T9WRY9YH
Created by admin on Sat Dec 16 19:30:19 GMT 2023 , Edited by admin on Sat Dec 16 19:30:19 GMT 2023
PRIMARY
CAS
1185297-20-4
Created by admin on Sat Dec 16 19:30:19 GMT 2023 , Edited by admin on Sat Dec 16 19:30:19 GMT 2023
PRIMARY
PUBCHEM
44217130
Created by admin on Sat Dec 16 19:30:19 GMT 2023 , Edited by admin on Sat Dec 16 19:30:19 GMT 2023
PRIMARY