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FSY-OSO2F

CAT: 0931-T86472-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T86472-01Size:25 mg
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CAS Number
1839622-49-9
Target
Others
Related Pathways
Others
Bioactivity
FSY-OSO2F, after labeling with isotope 18 F, is used as an amino acid tracer for subcutaneous MCF-7 tumors. It shows uptake in MCF-7 cells through regulation of L-Tyr, ASC, and ASC2 transporters, and also visualizes the U78MG glioma labeled with 18 F [1].
Smiles
O(S(F)(=O)=O)C1=CC=C(C[C@@H](C(O)=O)N)C=C1
Molecular Formula
C9H10FNO5S
Molecular Weight
263.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(S)-2-Amino-3-(4-((fluorosulfonyl)oxy)phenyl)propanoic acid
CAS Number1839622-49-9
PubChem CID118561836
IUPAC Name(2S)-2-amino-3-(4-fluorosulfonyloxyphenyl)propanoic acid
Molecular FormulaC9H10FNO5S
Molecular Weight263.24
XLogP-1
Topological Polar Surface Area115
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity358
SMILES
C1=CC(=CC=C1C[C@@H](C(=O)O)N)OS(=O)(=O)F
InChI
InChI=1S/C9H10FNO5S/c10-17(14,15)16-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
InChIKey
IVWVAUUBEKCCJQ-QMMMGPOBSA-N
Chemical Structure
2D Structure
2D structure of (S)-2-Amino-3-(4-((fluorosulfonyl)oxy)phenyl)propanoic acid
CAS: 1839622-49-9
CID: 118561836
Formula: C9H10FNO5S
MW: 263.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight263.24
XLogP3-1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass263.02637176
Monoisotopic Mass263.02637176
Topological Polar Surface Area115 Ų
Heavy Atom Count17
Formal Charge0
Complexity358
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