CHEBI:31054 - 12-Deoxyaklanonic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 12-Deoxyaklanonic acid
ChEBI ID CHEBI:31054
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H18O7
Net Charge 0
Average Mass 382.364
Monoisotopic Mass 382.10525
InChI InChI=1S/C21H18O7/c1-2-13(22)9-15(24)18-12(8-16(25)26)7-11-6-10-4-3-5-14(23)17(10)20(27)19(11)21(18)28/h3-5,7,23,28H,2,6,8-9H2,1H3,(H,25,26)
InChIKey GOOWFUBMXUJYPR-UHFFFAOYSA-N
SMILES CCC(=O)CC(=O)c1c(CC(O)=O)cc2Cc3cccc(O)c3C(=O)c2c1O
ChEBI Ontology
Outgoing 12-Deoxyaklanonic acid (CHEBI:31054) is a anthracenes (CHEBI:46955)
Synonym Source
12-Deoxyaklanonic acid KEGG COMPOUND
Manual Xref Database
C12420 KEGG COMPOUND
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Last Modified
28 July 2014