input word = C00064066

Metabolite InformationStructural formula
Name Fumaranine
Formula C20H21NO5
Mw 355.14197279
CAS RN 1863889-88-6
C_ID C00064066
InChIKey AALFLJDIYZQWEZ-UXHICEINSA-N
InChICode InChI=1S/C20H21NO5/c1-23-15-7-11-5-6-21-20(13(11)8-16(15)24-2)9-12-3-4-14-18(26-10-25-14)17(12)19(20)22/h3-4,7-8,19,21-22H,5-6,9-10H2,1-2H3/t19-,20+/m1/s1
SMILES COc1cc2c(cc1OC)C1(Cc3ccc4c(c3C1O)OCO4)NCC2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFumariaceaeFumaria officinalis Ref.
zoom in