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3,5-Dihydroxy-L-Tyrosine

CAT: 1596-AR-T06235-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-T06235-01Size:10 Units
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CAS Number
18674-59-4
Synonyms
3- (3,4,5-trihydroxyphenyl) alanine
Molecular Formula
C9H11NO5
Molecular Weight
213.19
API Name
Tyrosine

Chemical Information

5-Hydroxydopa

3,5-Dihydroxytyrosine has been reported in Stomphia coccinea, Urticina felina, and Metridium senile with data available.

CAS Number18674-59-4
PubChem CID161161
IUPAC Name(2S)-2-amino-3-(3,4,5-trihydroxyphenyl)propanoic acid
Molecular FormulaC9H11NO5
Molecular Weight213.19
XLogP-3.1
Topological Polar Surface Area124
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity223
SMILES
C1=C(C=C(C(=C1O)O)O)C[C@@H](C(=O)O)N
InChI
InChI=1S/C9H11NO5/c10-5(9(14)15)1-4-2-6(11)8(13)7(12)3-4/h2-3,5,11-13H,1,10H2,(H,14,15)/t5-/m0/s1
InChIKey
KQZQZOQFUQXPLW-YFKPBYRVSA-N
Chemical Structure
2D Structure
2D structure of 5-Hydroxydopa
CAS: 18674-59-4
CID: 161161
Formula: C9H11NO5
MW: 213.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight213.19
XLogP3-3.1
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass213.06372245
Monoisotopic Mass213.06372245
Topological Polar Surface Area124 Ų
Heavy Atom Count15
Formal Charge0
Complexity223
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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