U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C17H19NO4
Molecular Weight 301.3371
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIHYDRO-N-CAFFEOYLTYRAMINE

SMILES

OC1=CC=C(CCNC(=O)CCC2=CC(O)=C(O)C=C2)C=C1

InChI

InChIKey=RIYORZPRGANLCW-UHFFFAOYSA-N
InChI=1S/C17H19NO4/c19-14-5-1-12(2-6-14)9-10-18-17(22)8-4-13-3-7-15(20)16(21)11-13/h1-3,5-7,11,19-21H,4,8-10H2,(H,18,22)

HIDE SMILES / InChI

Molecular Formula C17H19NO4
Molecular Weight 301.3371
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 10:52:09 UTC 2023
Edited
by admin
on Sat Dec 16 10:52:09 UTC 2023
Record UNII
9BS8U8P69Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIHYDRO-N-CAFFEOYLTYRAMINE
Common Name English
3,4-DIHYDROXY-N-(2-(4-HYDROXYPHENYL)ETHYL)BENZENEPROPANAMIDE
Systematic Name English
BENZENEPROPANAMIDE, 3,4-DIHYDROXY-N-(2-(4-HYDROXYPHENYL)ETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
9BS8U8P69Q
Created by admin on Sat Dec 16 10:52:09 UTC 2023 , Edited by admin on Sat Dec 16 10:52:09 UTC 2023
PRIMARY
PUBCHEM
16119668
Created by admin on Sat Dec 16 10:52:09 UTC 2023 , Edited by admin on Sat Dec 16 10:52:09 UTC 2023
PRIMARY
CAS
501939-19-1
Created by admin on Sat Dec 16 10:52:09 UTC 2023 , Edited by admin on Sat Dec 16 10:52:09 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
A 70% aq. acetone extract prepared from the leaves of N. tabacum was partitioned between EtOAc and H2O. TMV infection inhibition activity of compound 20.1 ? 2.2%.