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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H13BrN2O4
Molecular Weight 305.125
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2S)-3-(3-BROMO-4,5-DIHYDROXYPHENYL)-2-HYDRAZINO-2-METHYLPROPANOIC ACID

SMILES

C[C@@](CC1=CC(Br)=C(O)C(O)=C1)(NN)C(O)=O

InChI

InChIKey=FHNPUJKHGIKUPC-JTQLQIEISA-N
InChI=1S/C10H13BrN2O4/c1-10(13-12,9(16)17)4-5-2-6(11)8(15)7(14)3-5/h2-3,13-15H,4,12H2,1H3,(H,16,17)/t10-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
CARBIDOPA IMPURITY I [EP IMPURITY]
Preferred Name English
(2S)-3-(3-BROMO-4,5-DIHYDROXYPHENYL)-2-HYDRAZINO-2-METHYLPROPANOIC ACID
Systematic Name English
3-BROMO-.ALPHA.-HYDRAZINYL-4,5-DIHYDROXY-.ALPHA.-METHYLBENZENEPROPANOIC ACID
Systematic Name English
BENZENEPROPANOIC ACID, 3-BROMO-.ALPHA.-HYDRAZINYL-4,5-DIHYDROXY-.ALPHA.-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
VFC2H8CA32
Created by admin on Wed Apr 02 12:45:52 GMT 2025 , Edited by admin on Wed Apr 02 12:45:52 GMT 2025
PRIMARY
PUBCHEM
95162155
Created by admin on Wed Apr 02 12:45:52 GMT 2025 , Edited by admin on Wed Apr 02 12:45:52 GMT 2025
PRIMARY
EPA CompTox
DTXSID30747219
Created by admin on Wed Apr 02 12:45:52 GMT 2025 , Edited by admin on Wed Apr 02 12:45:52 GMT 2025
PRIMARY
CAS
1246819-09-9
Created by admin on Wed Apr 02 12:45:52 GMT 2025 , Edited by admin on Wed Apr 02 12:45:52 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966