CHEBI:131388 - 1,2,3-butanetriol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,2,3-butanetriol
ChEBI ID CHEBI:131388
Definition A triol that is butane carrying three hydroxy substituents at position 1, 2 and 3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C4H10O3
Net Charge 0
Average Mass 106.121
Monoisotopic Mass 106.06299
InChI InChI=1S/C4H10O3/c1-3(6)4(7)2-5/h3-7H,2H2,1H3
InChIKey YAXKTBLXMTYWDQ-UHFFFAOYSA-N
SMILES OC(C(O)C)CO
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
Homo sapiens (NCBI:txid9606) See: PubMed
ChEBI Ontology
Outgoing 1,2,3-butanetriol (CHEBI:131388) has parent hydride butane (CHEBI:37808)
1,2,3-butanetriol (CHEBI:131388) is a triol (CHEBI:27136)
IUPAC Name
butane-1,2,3-triol
Synonym Source
1,2,3-trihydroxybutane ChEBI
Manual Xrefs Databases
19304 ChemSpider
FDB013331 FooDB
HMDB0034778 HMDB
View more database links
Registry Numbers Types Sources
1633470 Reaxys Registry Number Reaxys
4435-50-1 CAS Registry Number NIST Chemistry WebBook
4435-50-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
10788314 PubMed citation Europe PMC
23727864 PubMed citation Europe PMC
28520403 PubMed citation Europe PMC
3769520 PubMed citation Europe PMC
Last Modified
05 March 2021