input word = C00057650

Metabolite InformationStructural formula
Name Saminol
Formula C13H14O6
Mw 266.07903818
CAS RN 914253-78-4
C_ID C00057650
InChIKey WQXKWXBSRXGYLX-VLIVSTDHSA-N
InChICode InChI=1S/C13H14O6/c14-9-2-11-10(18-5-19-11)1-6(9)12-7-3-17-13(15)8(7)4-16-12/h1-2,7-8,12-15H,3-5H2/t7-,8-,12+,13-/m0/s1
SMILES Oc1cc2c(cc1[C@H]1OC[C@H]3[C@@H]1CO[C@@H]3O)OCO2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePedaliaceaeSesamum indicum Ref.
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OrganismSesamum indicum
ReferenceBoesken, J. et al., Recl. Trav. Chim. (J. R. Neth. Chem. Soc.), 1936, 55, 815