Want to comment
on this record?

2-[5-(Propionyloxy)-1H-indol-3-yl]ethanaminium 5-carboxypentanoate

ChemSpider ID: 27611
Molecular Formula: C₁₉H₂₆N₂O₆
Average mass: 378.419495 Da
Monoisotopic mass: 378.179077 Da
Systematic name

2-[5-(Propionyloxy)-1H-indol-3-yl]ethanaminium 5-carboxypentanoate
SMILES and InChIs

SMILES:

[O-]C(=O)CCCCC(=O)O.O=C(Oc1cc2c(cc1)ncc2CC[NH3+])CC Copied

Std. InChI:

InChI=1S/C13H16N2O2.C6H10O4/c1-2-13(16)17-10-3-4-12-11(7-10)9(5-6-14)8-15-12;7-5(8)3-1-2-4-6(9)10/h3-4,7-8,15H,2,5-6,14H2,1H3;1-4H2,(H,7,8)(H,9,10) Copied

Std. InChIKey:

IDXQIEVKXTZICM-UHFFFAOYSA-N Copied
Cite this record
CSID:27611, http://www.chemspider.com/Chemical-Structure.27611.html (accessed 22:40, May 18, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

19628-28-5 [RN]

Indol-5-ol, 3-(2-aminoethyl)-, propionate (ester), adipate (1:1)

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Click to predict properties on the Chemicalize site

Patents	Personal Collections
Publication or Magazine Article	Web-based Article (blog or commentary)
Available Chemicals Databases	Biological Properties
Chemical Reactions	Chemical Safety Data
Drugs or Compounds in Development	Imaging Agents
Information Aggregators	Journal Publishers via MeSH
Ligand/binding/crystal Structure Databases	Metabolic Pathways
Molecular Libraries Screening Center Network	Natural Products
NIH Substance Repository	Physical Properties (including SAR/QSAR databases)
Protein 3D Structures	Spectroscopy Databases
Substance Vendors	Theoretical Properties
Toxicology/Environmental Databases	Virtual Library

Advertise Sponsor