BMRB

Biological Magnetic Resonance Data Bank


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

L-Gulonolactone

Graphical representations:

L-Gulonolactone image

Molecular Formula: C6 H10 O6

Natural Isotopic Abundance Mass: 178.14

Mono-Isotopic Molecular Masses:

  • C12N14: 178.047738054
  • C13N14: 184.06786708
  • C12N15: 178.047738054
  • C13N15: 184.06786708

InCHi String:

isomeric SMILES: C([C@@H]([C@@H]1[C@@H]([C@@H](C(=O)O1)O)O)O)O

canonical SMILES: C(C(C1C(C(C(=O)O1)O)O)O)O

IUPAC: IUPAC systematic
(3S,4S,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-oxolan-2-one

IUPAC traditional: IUPAC cas: IUPAC openeye
(3S,4S,5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-tetrahydrofuran-2-one

PubChem Substance (SID):   85165043   4282
PubChem Compound (CID):   439373
KEGG: Compound ID   C01040
CAS Registry IDs:   1128-23-0
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.