CHEBI:31956 - PD116740

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name PD116740
ChEBI ID CHEBI:31956
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H16O7
Net Charge 0
Average Mass 368.338
Monoisotopic Mass 368.08960
InChI InChI=1S/C20H16O7/c1-27-12-4-2-3-9-14(12)19(25)16-15(17(9)23)13-10(18(24)20(16)26)5-8(7-21)6-11(13)22/h2-6,18,20-22,24,26H,7H2,1H3/t18-,20-/m1/s1
InChIKey ZJSLMQLVFYXGOW-UYAOXDASSA-N
SMILES COc1cccc2C(=O)C3=C([C@@H](O)[C@H](O)c4cc(CO)cc(O)c34)C(=O)c12
ChEBI Ontology
Outgoing PD116740 (CHEBI:31956) is a p-quinones (CHEBI:25830)
Synonym Source
PD116740 KEGG COMPOUND
Manual Xref Database
C12401 KEGG COMPOUND
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Last Modified
14 June 2016