BMRB

Biological Magnetic Resonance Data Bank


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

2-methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic Acid

2-methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic Acid synonyms

Ectoine

Wikipedia:

Graphical representations:

2-methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid image

Molecular Formula: C6H10N2O2

Natural Isotopic Abundance Mass: 142.1558

Mono-Isotopic Molecular Masses:

  • C12N14: 142.07422757
  • C13N14: 148.094356598
  • C12N15: 144.068297356
  • C13N15: 150.088426384

InCHi String: InChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1

SMILES:

PubChem Substance (SID):   n/a
PubChem Compound (CID):   126041
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   4CS
Miscellaneous Databases and IDs:   MMCD cq_18997

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.