BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules 		Member of WWPDB

Serotonin

Serotonin bmse000757 - Data

Serotonin synonyms

Serotonin; Thrombocytin; 3-(2-Aminoethyl)-1H-indol-5-ol; 5-HT; Ds substance; Antemovis; 5-Hta; 5-Hydroxy-3-(beta-aminoethyl)indole; Antemoqua; Indol-5-ol, 3-(2-aminoethyl)-; 3-(2-Aminoethyl)indol-5-ol

Wikipedia:

Graphical representations:

serotonin image

Molecular Formula: C10 H12 N2 O

Natural Isotopic Abundance Mass: 176.21508

Mono-Isotopic Molecular Masses:

  • C12N14: 176.0949630177
  • C13N14: 186.1285113957
  • C12N15: 178.0890328041
  • C13N15: 188.1225811821

InCHi String: InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2

canonical and isomeric SMILES: C1=CC2=C(C=C1O)C(=CN2)CCN

PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME
3-(2-aminoethyl)-1H-indol-5-ol

PUBCHEM iupac SYSTEMATIC NAME
3-(2-azanylethyl)-1H-indol-5-ol

PubChem Substance (SID):   111677885   148566   4041
PubChem Compound (CID):   5202
KEGG: Compound ID   C00780
CAS Registry IDs:   50-67-9
PDB Chemical Component   SRO
Miscellaneous Databases and IDs:   CAS 50-67-9   MMCD cq_00526   ChemIDplus 000050679   EINECS 200-058-9   NIAID 166243   Beilstein Handbook Reference 5-22-12-00016   NCGC NCGC00142449-02   NIST 470768363

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.