CHEBI:52688 - (S)-butane-1,3-diol

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ChEBI Name (S)-butane-1,3-diol
ChEBI ID CHEBI:52688
ChEBI ASCII Name (S)-butane-1,3-diol
Definition A butane-1,3-diol of S-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C4H10O2
Net Charge 0
Average Mass 90.12100
Monoisotopic Mass 90.06808
InChI InChI=1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3/t4-/m0/s1
InChIKey PUPZLCDOIYMWBV-BYPYZUCNSA-N
SMILES C[C@H](O)CCO
ChEBI Ontology
Outgoing (S)-butane-1,3-diol (CHEBI:52688) has parent hydride butane (CHEBI:37808)
(S)-butane-1,3-diol (CHEBI:52688) is a butane-1,3-diol (CHEBI:52683)
(S)-butane-1,3-diol (CHEBI:52688) is enantiomer of (R)-butane-1,3-diol (CHEBI:52687)
Incoming (R)-butane-1,3-diol (CHEBI:52687) is enantiomer of (S)-butane-1,3-diol (CHEBI:52688)
IUPAC Name
(3S)-butane-1,3-diol
Synonym Source
(S)-(+)-Butane-1,3-diol ChemIDplus
Registry Numbers Types Sources
1718943 Beilstein Registry Number Beilstein
1994384 Gmelin Registry Number Gmelin
24621-61-2 CAS Registry Number NIST Chemistry WebBook
24621-61-2 CAS Registry Number ChemIDplus
Last Modified
02 July 2009