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Details

Stereochemistry RACEMIC
Molecular Formula C21H29NO2
Molecular Weight 327.4605
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of UR-144 N(4-HYDROXYPENTYL)

SMILES

CC(O)CCCN1C=C(C(=O)C2C(C)(C)C2(C)C)C3=CC=CC=C13

InChI

InChIKey=YHFHYHZNLCEAAP-UHFFFAOYSA-N
InChI=1S/C21H29NO2/c1-14(23)9-8-12-22-13-16(15-10-6-7-11-17(15)22)18(24)19-20(2,3)21(19,4)5/h6-7,10-11,13-14,19,23H,8-9,12H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C21H29NO2
Molecular Weight 327.4605
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:20:11 UTC 2023
Edited
by admin
on Sat Dec 16 11:20:11 UTC 2023
Record UNII
HOM2IB42C4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
UR-144 N(4-HYDROXYPENTYL)
Common Name English
UR-144 N-(4-HYDROXYPENTYL)METABOLITE
Common Name English
METHANONE, (1-(4-HYDROXYPENTYL)-1H-INDOL-3-YL)(2,2,3,3-TETRAMETHYLCYCLOPROPYL)-
Systematic Name English
4-HYDROXY-UR-144
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID801043116
Created by admin on Sat Dec 16 11:20:11 UTC 2023 , Edited by admin on Sat Dec 16 11:20:11 UTC 2023
PRIMARY
PUBCHEM
91736656
Created by admin on Sat Dec 16 11:20:11 UTC 2023 , Edited by admin on Sat Dec 16 11:20:11 UTC 2023
PRIMARY
FDA UNII
HOM2IB42C4
Created by admin on Sat Dec 16 11:20:11 UTC 2023 , Edited by admin on Sat Dec 16 11:20:11 UTC 2023
PRIMARY
CAS
1537889-04-5
Created by admin on Sat Dec 16 11:20:11 UTC 2023 , Edited by admin on Sat Dec 16 11:20:11 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
22 ng/mL (serum, ER arrival); 10 ng/mL (serum, 10h after ER arrival)
IN-VIVO
Scientific Literature