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

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H31NO3
Molecular Weight 369.4971
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NORGESTIMATE, E-

SMILES

[H][C@@]12CC[C@@](OC(C)=O)(C#C)[C@@]1(CC)CC[C@]3([H])[C@@]4([H])CC\C(C=C4CC[C@@]23[H])=N/O

InChI

InChIKey=KIQQMECNKUGGKA-NMYWJIRASA-N
InChI=1S/C23H31NO3/c1-4-22-12-10-19-18-9-7-17(24-26)14-16(18)6-8-20(19)21(22)11-13-23(22,5-2)27-15(3)25/h2,14,18-21,26H,4,6-13H2,1,3H3/b24-17+/t18-,19+,20+,21-,22-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
NORGESTIMATE, E-
Common Name English
18,19-DINORPREGN-4-EN-20-YN-3-ONE, 17-(ACETYLOXY)-13-ETHYL-, 3-OXIME, (3E,17.ALPHA.)-
Systematic Name English
ANTI-NORGESTIMATE
Common Name English
Code System Code Type Description
PUBCHEM
6540478
Created by admin on Sat Dec 16 16:56:45 GMT 2023 , Edited by admin on Sat Dec 16 16:56:45 GMT 2023
PRIMARY
FDA UNII
NKX8DN6TY9
Created by admin on Sat Dec 16 16:56:45 GMT 2023 , Edited by admin on Sat Dec 16 16:56:45 GMT 2023
PRIMARY
CAS
107382-52-5
Created by admin on Sat Dec 16 16:56:45 GMT 2023 , Edited by admin on Sat Dec 16 16:56:45 GMT 2023
PRIMARY