Basic information
- CAS
16310-20-6- Standard SMILES
NCCc1c[nH]c2ccc(OS(=O)(=O)O)cc12- InChIKey
JFWYSGGSCOOBGK-UHFFFAOYSA-N- Molecular formula
- C10H12N2O4S
- Average molar mass
- 256.28 g/mol
- Monoisotopic mass
- 256.05177804
Overview
found in superfusates of rat spinal cord; RN given refers to hydrogen sulfate ester
Names & identifiers
- Preferred name
- 5-Hydroxytryptamine O-sulfate
- IUPAC
- [3-(2-aminoethyl)-1H-indol-5-yl] hydrogen sulfate
- English name
- SEROTONIN O-SULFATE
- Molecular formula
- C10H12N2O4S
- Molecular weight
- 256.28
Names & synonyms
Serotonin O-sulfate16310-20-65-Hydroxytryptamine O-sulfateDTXSID901675151H-Indol-5-ol, 3-(2-aminoethyl)-, hydrogen sulfate (ester)RefChem:102941DTXCID9090006[3-(2-aminoethyl)-1H-indol-5-yl] hydrogen sulfate3-(2-aminoethyl)-1H-indol-5-yl hydrogen sulfate[3-(2-AMINOETHYL)-1H-INDOL-5-YL]OXIDANESULFONIC ACIDSCHEMBL29453237AKOS022181547
Show more names
Serotonin Impurity 7Serotonium o-sulfate
DB-347421[3-(2-amino-ethyl)-1H-indol-5-yl] hydrogen sulfate1H-Indol-5-ol, 3-(2-aminoethyl)-, 5-(hydrogen sulfate)124575-88-8
Database identifiers
- CAS
16310-20-6- PubChem CID
- 152151
- DTXSID
DTXSID90167515- Nikkaji
- J1.887.014B
Properties
Computed structural properties
- XLogP
- -2.7
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 354
Physicochemical properties
- Melting point
- 208 °C · 208°C
- Density
- 1.558 · 1.558±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Hygroscopic, -20°C Freezer, Under Inert Atmosphere
- solubility
- Methanol (Slightly), Water (Slightly, Heated)
- form
- Solid
- pka
- -4.01 · -4.01±0.18(Predicted)
- color
- White to Off-White
- Stability
- Hygroscopic
Chemistry & industry
Applications
UsesA metabolite of Serotonin (5-hydroxytryptamine, 5-HT).
Suppliers13 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
Hebei Shengyuan Jinlong Import and Export Co. LTD+86-17367750398 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
凯试（上海）科技有限公司021-50135380 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
HANGZHOU CLAP TECHNOLOGY CO.,LTD86-571-88216897,88216896 13588875226 · [email protected]
DONBOO AMINO ACID COMPANY13063595538 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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