input word = C00006599

Metabolite InformationStructural formula
Name Trianguletin
Formula C34H30O10
Mw 598.18389718
CAS RN 152246-60-1
C_ID C00006599 ,
InChIKey QNKBJLDBRALWTE-UHFFFAOYSA-N
InChICode InChI=1S/C34H30O10/c1-17-28(38)26(23(35)14-9-18-7-5-4-6-8-18)29(39)22(32(17)43-3)15-21-24(36)16-25(37)27-30(40)31(41)33(44-34(21)27)19-10-12-20(42-2)13-11-19/h4-8,10-13,16,36-39,41H,9,14-15H2,1-3H3
SMILES c12c(c(c(cc1O)O)Cc1c(c(c(c(c1O)C(=O)CCc1ccccc1)O)C)OC)oc(c(c2=O)O)c1ccc(cc1)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaePentagramma triangularis Ref.
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OrganismPentagramma triangularis
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 645,Biflavonyls

Roitman,Phytochem.,34,(1993),297

Iinuma,Phytochem.,35,(1994),1043