Date Severity Status Feedback
Mar 19 2022 9:45AM Normal Acknowledged http://www.chemspider.com/Chemical-Structure.5735.html The name of this compound doesn't seem correct. In my impression, all amino acids(except Glycene) is levorotation(-), so shouldn't the compound be L-(-)-Alanine?
The L/D notation can be confusing – L amino acids are not necessarily levorotatory. See this explanation (from https://chem.libretexts.org/Bookshelves/Biological_Chemistry/Supplemental_Modules_(Biological_Chemistry)/Proteins/Amino_Acids/Properties_of_Amino_Acids/Stereochemistry_of_Amino_Acids): "All common amino acids are the L-enantiomer (i.e. their Cα chiral center is the L-enantiomer), based on the structural comparison with L-glyceraldehyde. However, not all L-amino acids are Levorotatory, some are actually Dextrorotatory with regard to their optical activity. To (attempt) to avoid confusion, the optical activities are given as (+) for dextrorotatory, and (-) for levorotatory L(+)-alanine (this is the L-enantiomer and it is dextrorotatory) L(-)-serine (this is the L-enantiomer and it is levorotatory)"
Feb 12 2021 9:48AM Normal Acknowledged The Predicted Hydrogen Bond Donor count is shown to be 3 for the Predicted ACD/Labs software, but the actual value is 2.
I suspect the algorithm is counting the two protons on the nitrogen separately.
Jun 24 2011 4:27PM Normal Acknowledged Dear Chemspider, I wonder if it's possible to have isotope ratios and or the isotope spectra. If this was available from the SOAP API this would be even better! Thank you, Paul Benton
Hi, At the moment we don not have the type of data that you request but we will keep it listed as a suggested development project. Please email the ChemSpider inbox if you wish to discuss further aspects of the ChemSpider Data or APIs.