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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H18O5
Molecular Weight 254.279
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3,4,5-Trimethoxyphenyl)butyric acid, (R)-

SMILES

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

InChI

InChIKey=WBULUDGUWZFLMO-SECBINFHSA-N
InChI=1S/C13H18O5/c1-5-9(13(14)15)8-6-10(16-2)12(18-4)11(7-8)17-3/h6-7,9H,5H2,1-4H3,(H,14,15)/t9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H18O5
Molecular Weight 254.279
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 15:40:27 GMT 2023
Edited
by admin
on Sat Dec 16 15:40:27 GMT 2023
Record UNII
2F5XM8YG8Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3,4,5-Trimethoxyphenyl)butyric acid, (R)-
Systematic Name English
(αR)-α-Ethyl-3,4,5-trimethoxybenzeneacetic acid
Systematic Name English
Benzeneacetic acid, α-ethyl-3,4,5-trimethoxy-, (αR)-
Systematic Name English
(R)-2-(3,4,5-Trimethoxyphenyl)butyric acid
Systematic Name English
Code System Code Type Description
CAS
1212160-00-3
Created by admin on Sat Dec 16 15:40:27 GMT 2023 , Edited by admin on Sat Dec 16 15:40:27 GMT 2023
PRIMARY
PUBCHEM
40634420
Created by admin on Sat Dec 16 15:40:27 GMT 2023 , Edited by admin on Sat Dec 16 15:40:27 GMT 2023
PRIMARY
FDA UNII
2F5XM8YG8Z
Created by admin on Sat Dec 16 15:40:27 GMT 2023 , Edited by admin on Sat Dec 16 15:40:27 GMT 2023
PRIMARY