input word = C00008378

Metabolite InformationStructural formula
Name Neosilyhermin B
Formula C25H22O9
Mw 466.1263823
CAS RN 96238-87-8
C_ID C00008378 ,
InChIKey ODFCTVKAFKIYJI-AXFNCTOSNA-N
InChICode InChI=1S/C25H22O9/c1-32-20-6-11(2-4-15(20)28)24-14(10-26)22-13(3-5-16(29)25(22)34-24)19-9-18(31)23-17(30)7-12(27)8-21(23)33-19/h2-8,14,19,24,26-30H,9-10H2,1H3/t14-,19-,24-/m0/s1
SMILES COc1cc(C2Oc3c(O)ccc([C@@H]4CC(=O)c5c(O)cc(O)cc5O4)c3C2CO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSilybum marianum Ref.
zoom in