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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H24FNO4
Molecular Weight 421.4608
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of RP-61969

SMILES

CC(C)N1C(=O)C2=C(C=CC=C2)C(C3=CC=C(F)C=C3)=C1\C=C\[C@@H]4C[C@@H](O)CC(=O)O4

InChI

InChIKey=NNYJKTFIAUUWRQ-MCBHFWOFSA-N
InChI=1S/C25H24FNO4/c1-15(2)27-22(12-11-19-13-18(28)14-23(29)31-19)24(16-7-9-17(26)10-8-16)20-5-3-4-6-21(20)25(27)30/h3-12,15,18-19,28H,13-14H2,1-2H3/b12-11+/t18-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H24FNO4
Molecular Weight 421.4608
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 17:59:15 GMT 2025
Edited
by admin
on Mon Mar 31 17:59:15 GMT 2025
Record UNII
ARK1M2C75Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1(2H)-ISOQUINOLINONE, 4-(4-FLUOROPHENYL)-2-(1-METHYLETHYL)-3-((1E)-2-((2S,4R)-TETRAHYDRO-4-HYDROXY-6-OXO-2H-PYRAN-2-YL)ETHENYL)-
Preferred Name English
RP-61969
Code English
Code System Code Type Description
EPA CompTox
DTXSID001009447
Created by admin on Mon Mar 31 17:59:15 GMT 2025 , Edited by admin on Mon Mar 31 17:59:15 GMT 2025
PRIMARY
CAS
126059-69-6
Created by admin on Mon Mar 31 17:59:15 GMT 2025 , Edited by admin on Mon Mar 31 17:59:15 GMT 2025
PRIMARY
FDA UNII
ARK1M2C75Y
Created by admin on Mon Mar 31 17:59:15 GMT 2025 , Edited by admin on Mon Mar 31 17:59:15 GMT 2025
PRIMARY
PUBCHEM
6443973
Created by admin on Mon Mar 31 17:59:15 GMT 2025 , Edited by admin on Mon Mar 31 17:59:15 GMT 2025
PRIMARY