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Details

Stereochemistry RACEMIC
Molecular Formula C21H27NO4
Molecular Weight 357.4434
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-HYDROXYPROPAFENONE

SMILES

CCCNCC(O)COC1=C(C=C(O)C=C1)C(=O)CCC2=CC=CC=C2

InChI

InChIKey=LUTWDNUXHDYZRA-UHFFFAOYSA-N
InChI=1S/C21H27NO4/c1-2-12-22-14-18(24)15-26-21-11-9-17(23)13-19(21)20(25)10-8-16-6-4-3-5-7-16/h3-7,9,11,13,18,22-24H,2,8,10,12,14-15H2,1H3

HIDE SMILES / InChI

Molecular Formula C21H27NO4
Molecular Weight 357.4434
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:38:04 UTC 2023
Edited
by admin
on Sat Dec 16 09:38:04 UTC 2023
Record UNII
7AC8BF38NP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-HYDROXYPROPAFENONE
Common Name English
1-PROPANONE, 1-(5-HYDROXY-2-(2-HYDROXY-3-(PROPYLAMINO)PROPOXY)PHENYL)-3-PHENYL-
Systematic Name English
GPV-129
Code English
Code System Code Type Description
PUBCHEM
107927
Created by admin on Sat Dec 16 09:38:04 UTC 2023 , Edited by admin on Sat Dec 16 09:38:04 UTC 2023
PRIMARY
EPA CompTox
DTXSID701006775
Created by admin on Sat Dec 16 09:38:04 UTC 2023 , Edited by admin on Sat Dec 16 09:38:04 UTC 2023
PRIMARY
FDA UNII
7AC8BF38NP
Created by admin on Sat Dec 16 09:38:04 UTC 2023 , Edited by admin on Sat Dec 16 09:38:04 UTC 2023
PRIMARY
CAS
86384-10-3
Created by admin on Sat Dec 16 09:38:04 UTC 2023 , Edited by admin on Sat Dec 16 09:38:04 UTC 2023
PRIMARY
Related Record Type Details
BINDER->LIGAND
Related Record Type Details
PARENT -> METABOLITE ACTIVE