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Details

Stereochemistry ACHIRAL
Molecular Formula C19H21BO7
Molecular Weight 372.177
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of B-[2-Methoxy-5-[3-oxo-3-(3,4,5-trimethoxyphenyl)-1-propen-1-yl]phenyl]boronic acid

SMILES

COC1=CC(=CC(OC)=C1OC)C(=O)\C=C\C2=CC(B(O)O)=C(OC)C=C2

InChI

InChIKey=AKNGHUAJAODDJA-FNORWQNLSA-N
InChI=1S/C19H21BO7/c1-24-16-8-6-12(9-14(16)20(22)23)5-7-15(21)13-10-17(25-2)19(27-4)18(11-13)26-3/h5-11,22-23H,1-4H3/b7-5+

HIDE SMILES / InChI

Molecular Formula C19H21BO7
Molecular Weight 372.177
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 07:33:10 GMT 2025
Edited
by admin
on Wed Apr 02 07:33:10 GMT 2025
Record UNII
T5X2E7FJ3J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
B-[2-Methoxy-5-[3-oxo-3-(3,4,5-trimethoxyphenyl)-1-propen-1-yl]phenyl]boronic acid
Systematic Name English
YK-3-237
Preferred Name English
B-[2-Methoxy-5-[(1E)-3-oxo-3-(3,4,5-trimethoxyphenyl)-1-propen-1-yl]phenyl]boronic acid
Systematic Name English
Boronic acid, B-[2-methoxy-5-[(1E)-3-oxo-3-(3,4,5-trimethoxyphenyl)-1-propen-1-yl]phenyl]-
Systematic Name English
(2-Methoxy-5-(3-oxidanylidene-3-(3,4,5-trimethyloxyphenyl)prop-1-enyl)phenyl)boronic acid
Systematic Name English
Boronic acid, B-[2-methoxy-5-[3-oxo-3-(3,4,5-trimethoxyphenyl)-1-propen-1-yl]phenyl]-
Systematic Name English
Code System Code Type Description
FDA UNII
T5X2E7FJ3J
Created by admin on Wed Apr 02 07:33:10 GMT 2025 , Edited by admin on Wed Apr 02 07:33:10 GMT 2025
PRIMARY
CAS
1215281-19-8
Created by admin on Wed Apr 02 07:33:10 GMT 2025 , Edited by admin on Wed Apr 02 07:33:10 GMT 2025
PRIMARY
CAS
1361123-42-3
Created by admin on Wed Apr 02 07:33:10 GMT 2025 , Edited by admin on Wed Apr 02 07:33:10 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
24881094
Created by admin on Wed Apr 02 07:33:10 GMT 2025 , Edited by admin on Wed Apr 02 07:33:10 GMT 2025
PRIMARY