D-Dopa
C₉H₁₁NO₄·197.190 g/mol·CID 92222
IUPAC: (2R)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid
Also known as: 5796-17-8, 3-Hydroxy-D-tyrosine, 3,4-Dihydroxy-D-phenylalanine, (2R)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid, Dopa D-form (+14 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
197.190g/mol
Exact Mass
197.068808Da
Monoisotopic Mass
197.068808Da
XLogP
-2.7
Polar Surface Area
104.0Ų
Complexity
209
Formal Charge
0
H-Bond Donors
4
H-Bond Acceptors
5
Rotatable Bonds
3
Heavy Atoms
14
Stereo Centers
1
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 197.2 g/mol
MW ≤ 500
✓ -2.7
LogP ≤ 5
✓ 4
H-bond donors ≤ 5
✓ 5
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
GHS Hazard Classification
Warning
Hazards
H315Causes skin irritationH319Causes serious eye irritationH335May cause respiratory irritation
Source: PubChem GHS Classification. Always consult the SDS for handling.
Chemical IdentifiersSMILES · InChI
InChI
InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m1/s1