input word = C00006160

Metabolite InformationStructural formula
Name Isoswertisin 2''-acetate
Formula C24H24O11
Mw 488.13186161
CAS RN 51693-99-3
C_ID C00006160 ,
InChIKey JQUDPNSJXPBHNN-GECVQLCKNA-N
InChICode InChI=1S/C24H24O11/c1-10(26)33-24-21(31)20(30)17(9-25)35-23(24)19-16(32-2)8-14(29)18-13(28)7-15(34-22(18)19)11-3-5-12(27)6-4-11/h3-8,17,20-21,23-25,27,29-31H,9H2,1-2H3/t17-,20+,21-,23-,24+/m0/s1
SMILES COc1cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOchnaceaeBrackenridgea zanguebarica Ref.
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