CHEBI:6134 - Khellol glucoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Khellol glucoside
ChEBI ID CHEBI:6134
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H20O10
Net Charge 0
Average Mass 408.357
Monoisotopic Mass 408.10565
InChI InChI=1S/C19H20O10/c1-25-18-9-2-3-26-11(9)5-12-14(18)10(21)4-8(28-12)7-27-19-17(24)16(23)15(22)13(6-20)29-19/h2-5,13,15-17,19-20,22-24H,6-7H2,1H3/t13-,15-,16+,17-,19-/m1/s1
InChIKey SJRACCTZSAUMGO-WIMVFMHDSA-N
SMILES COc1c2ccoc2cc2oc(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(=O)c12
ChEBI Ontology
Outgoing Khellol glucoside (CHEBI:6134) is a organic heterotricyclic compound (CHEBI:26979)
Khellol glucoside (CHEBI:6134) is a oxacycle (CHEBI:38104)
Synonyms Sources
Khellol glucoside KEGG COMPOUND
Khelloside KEGG COMPOUND
Manual Xrefs Databases
C00002432 KNApSAcK
C09011 KEGG COMPOUND
View more database links
Registry Number Type Source
17226-75-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014