input word = C00009458

Metabolite InformationStructural formula
Name 3'-Methylorobol
3'-O-Methylorobol
Orobol 3'-methyl ether
Formula C16H12O6
Mw 300.06338812
CAS RN 36190-95-1
C_ID C00009458 ,
InChIKey ZMFBGWWGXBNJAC-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O6/c1-21-13-4-8(2-3-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3
SMILES c1(cc(c2c(c1)occ(c2=O)c1cc(c(cc1)O)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnaxagorea luzonensis A.GRAY Ref.
PlantaeAsteraceaeWyethia helenioides Ref.
PlantaeAsteraceaeWyethia mollis Ref.
PlantaeConvolvulaceaeErycibe expansa Ref.
PlantaeFabaceaeCytisus scoparius Ref.
PlantaeFabaceaeDalbergia inundata Ref.
PlantaeFabaceaeDalbergia parviflora Ref.
PlantaeFabaceaeDerris scandens Ref.
PlantaeFabaceaeLupinus albus Ref.
PlantaeFabaceaeThermopsis spp. Ref.
PlantaeMoraceaeCudrania cochinchinensis Ref.
--Moghania philippinensis Ref.
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OrganismDalbergia inundata
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 517,Isoflavonoids and neoflavonoids

Leite de Almeida,Phytochem.,13,(1974),751

Dement,Phytochem.,11,(1972),1089