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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H19NO6
Molecular Weight 345.3466
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(((1S)-1-(4-HYDROXYPHENYL)ETHYL)-(4-METHOXYPHENOXY)CARBONYL-AMINO)ACETIC ACID

SMILES

COC1=CC=C(OC(=O)N(CC(O)=O)[C@@H](C)C2=CC=C(O)C=C2)C=C1

InChI

InChIKey=WKOXKGXKUUIDDE-LBPRGKRZSA-N
InChI=1S/C18H19NO6/c1-12(13-3-5-14(20)6-4-13)19(11-17(21)22)18(23)25-16-9-7-15(24-2)8-10-16/h3-10,12,20H,11H2,1-2H3,(H,21,22)/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H19NO6
Molecular Weight 345.3466
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 16:31:15 GMT 2023
Edited
by admin
on Sat Dec 16 16:31:15 GMT 2023
Record UNII
8ATU0RB2V4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(((1S)-1-(4-HYDROXYPHENYL)ETHYL)-(4-METHOXYPHENOXY)CARBONYL-AMINO)ACETIC ACID
Systematic Name English
PELIGLITAZAR METABOLITE M3
Common Name English
Code System Code Type Description
PUBCHEM
118753086
Created by admin on Sat Dec 16 16:31:15 GMT 2023 , Edited by admin on Sat Dec 16 16:31:15 GMT 2023
PRIMARY
FDA UNII
8ATU0RB2V4
Created by admin on Sat Dec 16 16:31:15 GMT 2023 , Edited by admin on Sat Dec 16 16:31:15 GMT 2023
PRIMARY
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