input word = C00049588

Metabolite InformationStructural formula
Name Gemixanthone A
Formula C26H24O11
Mw 512.13186161
CAS RN 238750-51-1
C_ID C00049588 ,
InChIKey FKKSZBVQSIKKQM-UUSWMZEJNA-N
InChICode InChI=1S/C26H24O11/c1-31-14-7-12(28)8-15-20(14)21(29)13-9-18(34-4)25-26(24(13)35-15)37-23(19(10-27)36-25)11-5-16(32-2)22(30)17(6-11)33-3/h5-9,19,23,27-28,30H,10H2,1-4H3/t19-,23-/m0/s1
SMILES c12c(c(=O)c3c(o1)c1c(c(c3)OC)O[C@H]([C@@H](O1)c1cc(c(c(c1)OC)O)OC)CO)c(cc(c2)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum geminiflorum Ref.
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