| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 10 | Yes |
Popular Name: Tyramine Tyramine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 154375-43-6 , 25301-02-4 , 51-67-2 , 60-19-5 , 792855-14-2 , [51-67-2]
"Tryptamine hydrochloride, 99%"
1-Boc-piperidin-4-ylpropionic acid
2-(4-Hydroxyphenyl)ethylamine hydrochloride
2-(p-Hydroxyphenyl)ethylamine; 51-67-2; C00483; Tyramine
4-(2-Aminoethyl)phenol hydrochloride
4-Hydroxyphenethylamine hydrochloride
CHEBI:15276; CHEBI:9799; CHEBI:27174
p-(1,1,3,3-TETRAMETHYLBUTYL)PHENOL, polymer with ETHYLENE OXIDE and FORMALDEHYDE
Tyramine [51-67-2]; (4-(2-Amino-ethyl)-phenol
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.44 | 0.46 | -47.41 | 4 | 2 | 1 | 48 | 138.19 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 158 - 163 | Acros Organics |
| MP | 160-162 °C(lit.) | Indofine |
| MP | 160-162° | Oakwood Chemical |
| MP | 162 | TCI |
| BP [°C] | 175 - 181 (p=8 torr) | Acros Organics |
| BP | 175-181°/8mm | Oakwood Chemical |
| BP | 175-181°/8mmHg | Matrix Scientific |
| BP [°C] | 269 | Acros Organics |
| MP | 271 - 273 | Enamine Building Blocks |
| Mp [°C] | 271 - 274 | Acros Organics |
| Melting_Point | 271-274? | Alfa-Aesar |
| Melting_Point | 271-274° | Alfa-Aesar |
| MP | 271...273 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| UniProt Database Links | AAUA_ALCFA; AAUB_ALCFA; ADA2A_HUMAN; ADA2B_HUMAN; AGCT1_HORVU; AGCT2_HORVU; AMOH_ARTGO; AMO_ECOLI; AMO_ENTAE; AMO_KLEOK; AOC2_HUMAN; MFNA_ARCFU; MFNA_HALMA; MFNA_HALS3; MFNA_HALSA; MFNA_META3; MFNA_METAC; MFNA_METB6; MFNA_METBF; MFNA_METBU; MFNA_METHJ; MF | ChEBI |
| therap | adrenergic agonist | MicroSource Spectrum |
| Hazard | C: Corrosive | Acros Organics |
| Therapy | Dopamine receptor agonist | SMDC MicroSource |
| Patent Database Links | EP0811626; EP1541585; EP1568770; EP1669079; EP1815846; EP1829527; EP1829528; US2001039035; US2003026850; US2005020659; US2005096485; US2005267207; US2006110343; US2007207222; WO2006100468; WO2006113140; WO2007103687 | ChEBI |
| H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
| H phrase | H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage | Acros Organics |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| Target | Mitogen-activated protein kinase 12(P53778) | Herbal Ingredients Targets |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r | Acros Organics |
| R phrase | R34: Causes burns. | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| Reactome Database Links | REACT_1260 | ChEBI |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| TAAR1-2-E | Trace Amine-associated Receptor 1 (cluster #2 Of 2), Eukaryotic | Eukaryotes | 731 | 0.86 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| TAAR1_HUMAN | Q96RJ0 | Trace Amine-associated Receptor 1, Human | 731 | 0.86 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Monoamines are oxidized to aldehydes by MAOA and MAOB, producing NH3 and H2O2 |
| Description | Species |
|---|---|
| Amine ligand-binding receptors | |
| G alpha (s) signalling events |
No pre-computed analogs available. Try a structural similarity search.