input word = C00049906

Metabolite InformationStructural formula
Name Isagarin
(-)-Isagarin
Formula C15H12O4
Mw 256.07355887
CAS RN 212068-91-2
C_ID C00049906 ,
InChIKey ZKIRNBLLNJPYKG-UXYSATNRNA-N
InChICode InChI=1S/C15H12O4/c1-15-6-10-12(11(19-15)7-18-15)14(17)9-5-3-2-4-8(9)13(10)16/h2-5,11H,6-7H2,1H3/t11-,15-/m0/s1
SMILES c12c(C(=O)C3=C(C1=O)[C@H]1O[C@](C3)(C)OC1)cccc2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaePentas longiflora Ref.
zoom in



OrganismPentas longiflora
ReferencePuyvelde,J.Nat.Prod.,61,(1998),1020