CHEBI:4320 - Daphneticin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Daphneticin
ChEBI ID CHEBI:4320
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H18O8
Net Charge 0
Average Mass 386.353
Monoisotopic Mass 386.10017
InChI InChI=1S/C20H18O8/c1-24-13-7-11(8-14(25-2)17(13)23)18-15(9-21)27-20-12(26-18)5-3-10-4-6-16(22)28-19(10)20/h3-8,15,18,21,23H,9H2,1-2H3/t15-,18-/m1/s1
InChIKey QLFQDIADUIVNRF-CRAIPNDOSA-N
SMILES COc1cc(cc(OC)c1O)[C@H]1Oc2ccc3ccc(=O)oc3c2O[C@@H]1CO
ChEBI Ontology
Outgoing Daphneticin (CHEBI:4320) is a oxacycle (CHEBI:38104)
Synonym Source
Daphneticin KEGG COMPOUND
Manual Xrefs Databases
C00002986 KNApSAcK
C09924 KEGG COMPOUND
View more database links
Registry Number Type Source
83327-22-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014