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Details

Stereochemistry ACHIRAL
Molecular Formula C25H24FNO2
Molecular Weight 389.462
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MAM-2201 N-(4-HYDROXYPENTYL)METABOLITE

SMILES

CC1=CC=C(C(=O)C2=CN(CCCC(O)CF)C3=CC=CC=C23)C4=C1C=CC=C4

InChI

InChIKey=KKTSWDJPCZIFLG-UHFFFAOYSA-N
InChI=1S/C25H24FNO2/c1-17-12-13-22(20-9-3-2-8-19(17)20)25(29)23-16-27(14-6-7-18(28)15-26)24-11-5-4-10-21(23)24/h2-5,8-13,16,18,28H,6-7,14-15H2,1H3

HIDE SMILES / InChI

Molecular Formula C25H24FNO2
Molecular Weight 389.462
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 11:07:32 UTC 2023
Edited
by admin
on Sat Dec 16 11:07:32 UTC 2023
Record UNII
KZ2BB26N57
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MAM-2201 N-(4-HYDROXYPENTYL)METABOLITE
Common Name English
MAM2201 N-(4-HYDROXYPENTYL) METABOLITE
Common Name English
(1-(5-FLUORO-4-HYDROXYPENTYL)-1H-INDOL-3-YL)(4-METHYL-1-NAPHTHALENYL)METHANONE
Systematic Name English
MAM-2201 N-4-OH M
Common Name English
METHANONE, (1-(5-FLUORO-4-HYDROXYPENTYL)-1H-INDOL-3-YL)(4-METHYL-1-NAPHTHALENYL)-
Systematic Name English
Code System Code Type Description
CAS
1537889-05-6
Created by admin on Sat Dec 16 11:07:32 UTC 2023 , Edited by admin on Sat Dec 16 11:07:32 UTC 2023
PRIMARY
EPA CompTox
DTXSID801017791
Created by admin on Sat Dec 16 11:07:32 UTC 2023 , Edited by admin on Sat Dec 16 11:07:32 UTC 2023
PRIMARY
PUBCHEM
131668101
Created by admin on Sat Dec 16 11:07:32 UTC 2023 , Edited by admin on Sat Dec 16 11:07:32 UTC 2023
PRIMARY
FDA UNII
KZ2BB26N57
Created by admin on Sat Dec 16 11:07:32 UTC 2023 , Edited by admin on Sat Dec 16 11:07:32 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
ND to 1.75 ng/mL
IN-VIVO
URINE