input word = C00031233

Metabolite InformationStructural formula
Name Rubiadin-1-methyl ether
Formula C16H12O4
Mw 268.07355887
CAS RN 7460-43-7
C_ID C00031233 ,
InChIKey NTBUBTCXACOEEC-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O4/c1-8-12(17)7-11-13(16(8)20-2)15(19)10-6-4-3-5-9(10)14(11)18/h3-7,17H,1-2H3
SMILES c12c(C(=O)c3c(C1=O)cc(c(c3OC)C)O)cccc2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeHymenodictyon excelsum Ref.
PlantaeRubiaceaeMorinda citrifolia L. Ref.
PlantaeRubiaceaeMorinda umbellata Ref.
PlantaeRubiaceaeNeonauclea calycina Ref.
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OrganismHymenodictyon excelsum
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979)