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2D Structure
Also known as: Foscarbidopa, 1907685-81-7, Foscarbidopa [usan], 5nt8hca4oo, (2s)-2-hydrazinyl-3-[3-hydroxy-4-(phosphonooxy)phenyl]-, (2s)-2-hydrazinyl-3-(3-hydroxy-4-(phosphonooxy)phenyl)-2-methylpropanoic acid
Molecular Formula
C10H15N2O7P
Molecular Weight
306.21  g/mol
InChI Key
PQUZXFMHVSMUNG-JTQLQIEISA-N
FDA UNII
5NT8HCA4OO

Foscarbidopa is under investigation in clinical trial NCT04379050 (Extension Study to Evaluate Safety and Tolerability of 24-hour Daily Exposure of Continuous Subcutaneous Infusion of ABBV-951 in Adult Participants With Parkinson's Disease).
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-2-hydrazinyl-3-(3-hydroxy-4-phosphonooxyphenyl)-2-methylpropanoic acid
2.1.2 InChI
InChI=1S/C10H15N2O7P/c1-10(12-11,9(14)15)5-6-2-3-8(7(13)4-6)19-20(16,17)18/h2-4,12-13H,5,11H2,1H3,(H,14,15)(H2,16,17,18)/t10-/m0/s1
2.1.3 InChI Key
PQUZXFMHVSMUNG-JTQLQIEISA-N
2.1.4 Canonical SMILES
CC(CC1=CC(=C(C=C1)OP(=O)(O)O)O)(C(=O)O)NN
2.1.5 Isomeric SMILES
C[C@](CC1=CC(=C(C=C1)OP(=O)(O)O)O)(C(=O)O)NN
2.2 Other Identifiers
2.2.1 UNII
5NT8HCA4OO
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Foscarbidopa

2. 1907685-81-7

3. Foscarbidopa [usan]

4. 5nt8hca4oo

5. (2s)-2-hydrazinyl-3-[3-hydroxy-4-(phosphonooxy)phenyl]-

6. (2s)-2-hydrazinyl-3-(3-hydroxy-4-(phosphonooxy)phenyl)-2-methylpropanoic Acid

7. (2s)-2-hydrazinyl-3-[3-hydroxy-4-(phosphonooxy)phenyl]-2-methylpropanoic Acid

8. Abbv-951 Carbidopa

9. Unii-5nt8hca4oo

10. Foscarbidopa [inn]

11. Chembl4802240

12. Schembl17693633

13. Chebi:192511

14. Who 11007

15. Abbv-951 Component Foscarbidopa

16. Hy-109131

17. Cs-0086771

18. (2s)-2-hydrazinyl-3-(3-hydroxy-4-phosphonooxyphenyl)-2-methylpropanoic Acid

19. (alphas)-alpha-hydrazinyl-3-hydroxy-alpha-methyl-4-(phosphonooxy)benzenepropanoic Acid

20. Benzenepropanoic Acid, Alpha-hydrazinyl-3-hydroxy-alpha-methyl-4-(phosphonooxy)-, (alphas)-

21. (.alpha.s)-.alpha.-hydrazinyl-3-hydroxy-.alpha.-methyl-4-(phosphonooxy)benzenepropanoic Acid

22. Benzenepropanoic Acid, .alpha.-hydrazinyl-3-hydroxy-.alpha.-methyl-4-(phosphonooxy)-, (.alpha.s)-

2.4 Create Date
2016-08-06
3 Chemical and Physical Properties
Molecular Weight 306.21 g/mol
Molecular Formula C10H15N2O7P
XLogP3-5.8
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count9
Rotatable Bond Count6
Exact Mass306.06168782 g/mol
Monoisotopic Mass306.06168782 g/mol
Topological Polar Surface Area162 Ų
Heavy Atom Count20
Formal Charge0
Complexity401
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1