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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H33NO2
Molecular Weight 415.5671
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METAPRISTONE

SMILES

[H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@H](C3=CC=C(NC)C=C3)C4=C5CCC(=O)C=C5CC[C@@]24[H]

InChI

InChIKey=IBLXOBHABOVXDY-WKWWZUSTSA-N
InChI=1S/C28H33NO2/c1-4-14-28(31)15-13-25-23-11-7-19-16-21(30)10-12-22(19)26(23)24(17-27(25,28)2)18-5-8-20(29-3)9-6-18/h5-6,8-9,16,23-25,29,31H,7,10-13,15,17H2,1-3H3/t23-,24+,25-,27-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H33NO2
Molecular Weight 415.5671
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:22:14 GMT 2023
Edited
by admin
on Sat Dec 16 09:22:14 GMT 2023
Record UNII
K1P8OGJ86J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METAPRISTONE
Common Name English
ESTRA-4,9-DIEN-3-ONE, 17-HYDROXY-11-(4-(METHYLAMINO)PHENYL)-17-(1-PROPYNYL)-, (11.BETA.,17.BETA.)-
Systematic Name English
RU-42633
Code English
MIFEPRISTONE, N-MONODEMETHYL
Common Name English
DESMETHYLMIFEPRISTONE
Common Name English
N-DESMETHYL-RU 486
Common Name English
ESTRA-4,9-DIEN-3-ONE, 17-HYDROXY-11-(4-(METHYLAMINO)PHENYL)-17-(1-PROPYN-1-YL)-, (11.BETA.,17.BETA.)-
Systematic Name English
N-METHYLAMINOPRISTONE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID60146216
Created by admin on Sat Dec 16 09:22:14 GMT 2023 , Edited by admin on Sat Dec 16 09:22:14 GMT 2023
PRIMARY
WIKIPEDIA
Metapristone
Created by admin on Sat Dec 16 09:22:14 GMT 2023 , Edited by admin on Sat Dec 16 09:22:14 GMT 2023
PRIMARY
FDA UNII
K1P8OGJ86J
Created by admin on Sat Dec 16 09:22:14 GMT 2023 , Edited by admin on Sat Dec 16 09:22:14 GMT 2023
PRIMARY
PUBCHEM
10070462
Created by admin on Sat Dec 16 09:22:14 GMT 2023 , Edited by admin on Sat Dec 16 09:22:14 GMT 2023
PRIMARY
CAS
104004-96-8
Created by admin on Sat Dec 16 09:22:14 GMT 2023 , Edited by admin on Sat Dec 16 09:22:14 GMT 2023
PRIMARY
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ACTIVE MOIETY