input word = C00004857

Metabolite InformationStructural formula
Name Purpurascenin
Formula C23H26O10
Mw 462.15259705
CAS RN 79105-52-5
C_ID C00004857 ,
InChIKey DWKFMLSGCLXYER-UHFFFAOYSA-N
InChICode InChI=1S/C23H26O10/c1-25-12-10-14(27-3)13(26-2)9-11(12)17-20(29-5)16(24)15-18(28-4)21(30-6)23(32-8)22(31-7)19(15)33-17/h9-10H,1-8H3
SMILES c1(c(c(c2c(c1OC)oc(c(c2=O)OC)c1cc(c(cc1OC)OC)OC)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePogostemon purpurascens Ref.
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