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CHEBI:212986 - Diepoxin kappa

ChEBI IDCHEBI:212986
ChEBI NameDiepoxin kappa
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FormulaC21H18O8
Net Charge0
Average Mass398.367
Monoisotopic Mass398.10017
SMILESCO[C@@H]1CC(=O)[C@]23O[C@]2([C@@H](O)[C@H]2O[C@H]2C32Oc3cccc4cccc(c34)O2)[C@H]1O
InChIInChI=1S/C21H18O8/c1-25-12-8-13(22)20-19(29-20,16(12)23)17(24)15-18(26-15)21(20)27-10-6-2-4-9-5-3-7-11(28-21)14(9)10/h2-7,12,15-18,23-24H,8H2,1H3/t12-,15-,16+,17+,18-,19+,20+/m1/s1
InChIKeyWGCFPWGLKTUIGC-BTDHYDEWSA-N
ChEBI Ontology
Outgoing Relation(s)
Diepoxin kappa (CHEBI:212986) is a naphthalenes (CHEBI:25477)
IUPAC Name 
(1'S,2'S,3'R,5'R,7'R,10'R,11'S)-2',11'-dihydroxy-10'-methoxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,6'-4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodecane]-8'-one
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59008224ChemSpider