input word = C00057077

Metabolite InformationStructural formula
Name Neotussilagine
Formula C10H17NO3
Mw 199.12084342
CAS RN 147730-89-0
C_ID C00057077
InChIKey LADVYSUMGRTFSZ-OYNCUSHFSA-N
InChICode InChI=1S/C10H17NO3/c1-10(13)6-11-5-3-4-7(11)8(10)9(12)14-2/h7-8,13H,3-6H2,1-2H3/t7-,8-,10+/m0/s1
SMILES [H][C@]12N(C[C@@](C)(O)[C@@H]2C(OC)=O)CCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTussilago farfara Ref.
zoom in