bmse000068 L-(-) Arabitol at BMRB

L-(-) Arabitol
bmse000068 - data
bmse000802 - data
bmse000869 - data
bmst000271 - theory

L-(-) Arabitol

L-Arabitol; L-Arabinitol; L-Arabinol; L-Lyxitol

Molecular Formula: C5 H12 O5
Natural Isotopic Abundance Mass: 152.1457800000
Mono-Isotopic Molecular Masses: C12N14: 152.068473496; C13N14: 157.085247685; C12N15: 152.068473496; C13N15: 157.085247685

L-(-) Arabitol

InCHi String:
InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4-/m0/s1

isomeric SMILES:
C([C@@H](C([C@H](CO)O)O)O)O
canonical SMILES:
C(C(C(C(CO)O)O)O)O

IUPAC: IUPAC traditional: IUPAC cas: IUPAC openeye: IUPAC systematic
(2S,4S)-pentane-1,2,3,4,5-pentol

PubChem Substance (SID):   85164914   3814
PubChem Compound (CID):   439255
KEGG: Compound ID   C00532
CAS Registry IDs:   7643-75-6
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   CHEBI 18403

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.