EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:139896 - bkos#1

Default Structure
ChEBI IDCHEBI:139896
ChEBI Namebkos#1
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC13H22O7
Net Charge0
Average Mass290.312
Monoisotopic Mass290.13655
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)/t8-,10+,11+,13+/m0/s1
InChIKeyWYDXDFMJTTYATA-BQKRADJCSA-N
ChEBI Ontology
Outgoing Relation(s)
bkos#1 (CHEBI:139896) is a organic molecular entity (CHEBI:50860)