input word = C00019750

Metabolite InformationStructural formula
Name Mirabijalone D
3,6,11-Trihydroxy-9-methyl-10-methyl-6a,12a-didehydrorotenone
Formula C18H14O7
Mw 342.0739528
CAS RN 485811-84-5
C_ID C00019750 ,
InChIKey SUWMBRRWYKHHDH-UHFFFAOYNA-N
InChICode InChI=1S/C18H14O7/c1-7-10(23-2)6-12-14(15(7)20)16(21)13-9-4-3-8(19)5-11(9)25-18(22)17(13)24-12/h3-6,18-20,22H,1-2H3/t18-/m0/s1
SMILES COc1cc2oc3c(c(=O)c2c(O)c1C)-c1ccc(O)cc1OC3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeNyctaginaceaeMirabilis jalapa Ref.
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OrganismMirabilis jalapa
ReferenceWang,Helv. Chim. Acta,85,(2002),2342