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Details

Stereochemistry ACHIRAL
Molecular Formula C15H19NO3
Molecular Weight 261.3163
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-((4-ACETYL-2-ETHYL-PHENYL)METHYL)AZETIDINE-3-CARBOXYLIC ACID

SMILES

CCC1=CC(=CC=C1CN2CC(C2)C(O)=O)C(C)=O

InChI

InChIKey=SRJWRNKGAMJCKO-UHFFFAOYSA-N
InChI=1S/C15H19NO3/c1-3-11-6-12(10(2)17)4-5-13(11)7-16-8-14(9-16)15(18)19/h4-6,14H,3,7-9H2,1-2H3,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C15H19NO3
Molecular Weight 261.3163
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:02:22 UTC 2023
Edited
by admin
on Sat Dec 16 19:02:22 UTC 2023
Record UNII
YRQ6G55UHM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-((4-ACETYL-2-ETHYL-PHENYL)METHYL)AZETIDINE-3-CARBOXYLIC ACID
Systematic Name English
SIPONIMOD METABOLITE M1
Common Name English
Code System Code Type Description
PUBCHEM
154689102
Created by admin on Sat Dec 16 19:02:23 UTC 2023 , Edited by admin on Sat Dec 16 19:02:23 UTC 2023
PRIMARY
FDA UNII
YRQ6G55UHM
Created by admin on Sat Dec 16 19:02:23 UTC 2023 , Edited by admin on Sat Dec 16 19:02:23 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MINOR
FECAL; URINE