Psilocybin

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Systematic / IUPAC Name: 3-[2-(Dimethylamino)ethyl]-1H-indol-4-yl dihydrogen phosphate

ID: Reference5786

Other Names: Indocybin;
Psilocibin;
Psilocibina;
Psilocin phosphate ester;
Psilocine phosphate ; more

Formula: C12H17N2O4P

Class: Drugs of Abuse/Illegal Drugs Endogenous Metabolites

Spectral Data

Psilocybin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 4
No. of Spectra 458
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/29/2018 12:32:06 PM
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Identificators

InChI InChI=1S/C12H17N2O4P/c1-14(2)7-6-9-8-13-10-4-3-5-11(12(9)10)18-19(15,16)17/h3-5,8,13H,6-7H2,1-2H3,(H2,15,16,17)
InChI Key QVDSEJDULKLHCG-UHFFFAOYSA-N
Canonical SMILES CN(C)CCC1=CNC2=C1C(=CC=C2)OP(=O)(O)O
CAS 520525
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Other Names Indocybin;
Psilocibin;
Psilocibina;
Psilocin phosphate ester;
Psilocine phosphate;
Psilocybine;
Psilocybinum;
Psilotsibin;
Psylocybin;
Teonanacatl;
[3-(2-Dimethylaminoethyl)-1H-indol-4-yl] dihydrogen phosphate;
O-Phosphoryl-4-hydroxy-N,N-dimethyltryptamine;
1H-Indol-4-ol, 3-[2-(dimethylamino)ethyl], dihydrogen phosphate;
1H-Indol-4-ol, 3-[2-(dimethylamino)ethyl], dihydrogen phosphate (ester);
3-[2-(Dimethylamino)ethyl]-1H-indol-4-ol dihydrogen phosphate ester ;
3-(2-Dimethylaminoethyl)indol-4-yl dihydrogen phosphate;
3-[2-(Dimethylamino)ethyl]indol-4-ol dihydrogen phosphate ester;
3-[2-(Dimethylamino)ethyl]indol-4-yl dihydrogen phosphate;
3-2'-Dimethylaminoethylindol-4-phosphate;
4-Phosphoryloxy-ω-N,N-dimethyltryptamine;
Indol-4-ol, 3-[2-(dimethylamino)ethyl], dihydrogen phosphate ;
Indol-4-ol, 3-[2-(dimethylamino)ethyl], dihydrogen phosphate (ester)

In Other Databases

ChEBI CHEBI:8614
ChemIDPlus 000520525
Wikipedia Psilocybin
KEGG C07576
ChEMBL CHEMBL194378
ChemSpider 10178
PubChem 10624