input word = C00041342

Metabolite InformationStructural formula
Name Angulifolin B
(+)-Angulifolin B
Formula C18H18O7
Mw 346.10525293
CAS RN 918820-62-9
C_ID C00041342 ,
InChIKey QSPXRVDTGKRUHN-HSSJQDMBNA-N
InChICode InChI=1S/C18H18O7/c1-7-11-10(4-19)12-9(5-23-8(2)20)6-24-17(12)16(22-3)13(11)14(21)18-15(7)25-18/h4,6-7,14-15,18,21H,5H2,1-3H3/t7-,14-,15+,18-/m1/s1
SMILES c12c(c(c3c(c1C=O)[C@H]([C@H]1[C@@H]([C@@H]3O)O1)C)OC)occ2COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeRoldana angulifolia Ref.
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