input word = C00058820

Metabolite InformationStructural formula
Name (+)-Sesangolin
Formula C21H20O7
Mw 384.12090299
CAS RN
C_ID C00058820
InChIKey CXRGUJLWMNJJDZ-FWSJURHISA-N
InChICode InChI=1S/C21H20O7/c1-22-16-6-19-18(27-10-28-19)5-12(16)21-14-8-23-20(13(14)7-24-21)11-2-3-15-17(4-11)26-9-25-15/h2-6,13-14,20-21H,7-10H2,1H3/t13-,14-,20+,21-/m0/s1
SMILES [H][C@@]1([C@@H](C2=CC=C(OCO3)C3=C2)OC4)[C@@]4([H])[C@H](C5=C(OC)C=C(OCO6)C6=C5)OC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePedaliaceaeSesamum angolense Ref.
PlantaePedaliaceaeSesamum angustifolium Ref.
PlantaePedaliaceaeSesamum radiatum Ref.
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OrganismSesamum angolense
ReferenceOno,E.,Plant Cell Physiol.,59,(2018),2278