input word = C00005712

Metabolite InformationStructural formula
Name Gossypetin 7,8-dimethyl ether 4'-glucoside
Formula C23H24O13
Mw 508.12169086
CAS RN 161895-70-1
C_ID C00005712 ,
InChIKey JQTSPDOLJNZJQH-SSTKLSGJNA-N
InChICode InChI=1S/C23H24O13/c1-32-12-6-10(26)14-16(28)18(30)20(36-22(14)21(12)33-2)8-3-4-11(9(25)5-8)34-23-19(31)17(29)15(27)13(7-24)35-23/h3-6,13,15,17,19,23-27,29-31H,7H2,1-2H3/t13-,15-,17-,19-,23-/m1/s1
SMILES COc1cc(O)c2c(=O)c(O)c(-c3ccc(O[C@@H]4OC(CO)[C@@H](O)C(O)C4O)c(O)c3)oc2c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeErica cinerea Ref.
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