EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:139897 - bkos#1(1-)

Default Structure
ChEBI IDCHEBI:139897
ChEBI Namebkos#1(1-)
Stars
DefinitionConjugate base of bkos#1
SubmitterMichael Witting
DownloadsMolfile
FormulaC13H21O7
Net Charge-1
Average Mass289.304
Monoisotopic Mass289.12928
SMILESC[C@@H]1O[C@@H](OCCCCC(=O)CC(=O)[O-])[C@H](O)C[C@H]1O
InChIInChI=1S/C13H22O7/c1-8-10(15)7-11(16)13(20-8)19-5-3-2-4-9(14)6-12(17)18/h8,10-11,13,15-16H,2-7H2,1H3,(H,17,18)/p-1/t8-,10+,11+,13+/m0/s1
InChIKeyWYDXDFMJTTYATA-BQKRADJCSA-M
ChEBI Ontology
Outgoing Relation(s)
bkos#1(1-) (CHEBI:139897) is a organic molecular entity (CHEBI:50860)