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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H30N4O4
Molecular Weight 474.5515
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LY-368842

SMILES

CC(C)(CC1=CC=C(OC2=NC=C(C=C2)C(N)=O)C=C1)NC[C@H](O)COC3=C4C=CNC4=CC=C3

InChI

InChIKey=CFUCLSORVLFUGF-FQEVSTJZSA-N
InChI=1S/C27H30N4O4/c1-27(2,31-16-20(32)17-34-24-5-3-4-23-22(24)12-13-29-23)14-18-6-9-21(10-7-18)35-25-11-8-19(15-30-25)26(28)33/h3-13,15,20,29,31-32H,14,16-17H2,1-2H3,(H2,28,33)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H30N4O4
Molecular Weight 474.5515
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:58:40 UTC 2023
Edited
by admin
on Sat Dec 16 11:58:40 UTC 2023
Record UNII
B8NHE627FV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LY-368842
Common Name English
3-PYRIDINECARBOXAMIDE, 6-(4-(2-(((2S)-2-HYDROXY-3-(1H-INDOL-4-YLOXY)PROPYL)AMINO)-2-METHYLPROPYL)PHENOXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9804937
Created by admin on Sat Dec 16 11:58:40 UTC 2023 , Edited by admin on Sat Dec 16 11:58:40 UTC 2023
PRIMARY
FDA UNII
B8NHE627FV
Created by admin on Sat Dec 16 11:58:40 UTC 2023 , Edited by admin on Sat Dec 16 11:58:40 UTC 2023
PRIMARY
CAS
189119-00-4
Created by admin on Sat Dec 16 11:58:40 UTC 2023 , Edited by admin on Sat Dec 16 11:58:40 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> AGONIST
SHORT-ACTING
Related Record Type Details
ACTIVE MOIETY