5-Hydroxyindole-3-acetic Acid - CAS 54-16-0
Catalog: |
BB028533 |
Product Name: |
5-Hydroxyindole-3-acetic Acid |
CAS: |
54-16-0 |
Synonyms: |
2-(5-hydroxy-1H-indol-3-yl)acetic acid; 2-(5-hydroxy-1H-indol-3-yl)acetic acid |
IUPAC Name: | 2-(5-hydroxy-1H-indol-3-yl)acetic acid |
Description: | HIAA is an antagonist of histamine H1 receptor that is used to treat allergies. |
Molecular Weight: | 191.18 |
Molecular Formula: | C10H9NO3 |
Canonical SMILES: | C1=CC2=C(C=C1O)C(=CN2)CC(=O)O |
InChI: | InChI=1S/C10H9NO3/c12-7-1-2-9-8(4-7)6(5-11-9)3-10(13)14/h1-2,4-5,11-12H,3H2,(H,13,14) |
InChI Key: | DUUGKQCEGZLZNO-UHFFFAOYSA-N |
Boiling Point: | 497.1 °C at 760 mmHg |
Melting Point: | 146-148 °C (dec.) |
Density: | 1.496 g/cm3 |
Solubility: | >28.7 [ug/mL] (The mean of the results at pH 7.4) |
Appearance: | Light brown solid |
MDL: | MFCD00005639 |
LogP: | 1.50060 |
Publication Number | Title | Priority Date |
CN-113508752-A | Tissue culture and rapid propagation method for watermelons | 20210705 |
CN-113209039-A | Enterobacter capsule and preparation method thereof | 20210422 |
CN-112891359-A | Asiaticoside tablet | 20210318 |
US-11033208-B1 | Fixed operation time frequency sweeps for an analyte sensor | 20210205 |
CN-112843086-A | Polysaccharide freeze-dried powder with anti-depression effect and preparation method and application thereof | 20210201 |
PMID | Publication Date | Title | Journal |
32871117 | 20201101 | Characterization of indoleamine-2,3-dioxygenase 1, tryptophan-2,3-dioxygenase, and Ido1/Tdo2 knockout mice | Toxicology and applied pharmacology |
32243540 | 20200701 | Effects of Prenatal Exposure to a Mixture of Organophosphate Flame Retardants on Placental Gene Expression and Serotonergic Innervation in the Fetal Rat Brain | Toxicological sciences : an official journal of the Society of Toxicology |
32071231 | 20200303 | Bisphenol A and bisphenol S disruptions of the mouse placenta and potential effects on the placenta-brain axis | Proceedings of the National Academy of Sciences of the United States of America |
31150628 | 20190801 | Dose-dependent neuroprotective effect of oriental phyto-derived glycyrrhizin on experimental neuroterminal norepinephrine depletion in a rat brain model | Chemico-biological interactions |
28213524 | 20170407 | G protein-coupled receptor kinase-2 (GRK-2) regulates serotonin metabolism through the monoamine oxidase AMX-2 in Caenorhabditis elegans | The Journal of biological chemistry |
Complexity: | 231 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.058243149 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 73.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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