CHEBI:18395 - 2-dehydropantolactone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-dehydropantolactone
ChEBI ID CHEBI:18395
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11562, CHEBI:4552, CHEBI:19546
Supplier Information
Download Molfile XML SDF
Formula C6H8O3
Net Charge 0
Average Mass 128.12592
Monoisotopic Mass 128.04734
InChI InChI=1S/C6H8O3/c1-6(2)3-9-5(8)4(6)7/h3H2,1-2H3
InChIKey HRTOQFBQOFIFEE-UHFFFAOYSA-N
SMILES CC1(C)COC(=O)C1=O
ChEBI Ontology
Outgoing 2-dehydropantolactone (CHEBI:18395) has functional parent pantoic acid (CHEBI:14737)
2-dehydropantolactone (CHEBI:18395) is a tetrahydrofurandione (CHEBI:47022)
IUPAC Name
4,4-dimethyl-4,5-dihydrofuran-2,3-dione
Synonyms Sources
2-Dehydropantolactone KEGG COMPOUND
2-dehydropantolactone UniProt
2-Dehydropantoyl lactone KEGG COMPOUND
Dihydro-4,4-dimethyl-2,3-Furandione KEGG COMPOUND
Manual Xref Database
C01125 KEGG COMPOUND
View more database links
Registry Number Type Source
13031-04-4 CAS Registry Number KEGG COMPOUND
Last Modified
13 November 2014