input word = C00057078

Metabolite InformationStructural formula
Name Neoisotussilagine
Formula C10H17NO3
Mw 199.12084342
CAS RN 147730-90-3
C_ID C00057078
InChIKey LADVYSUMGRTFSZ-NRPADANISA-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(CCC2)C[C@](O)([C@@H]1C(OC)=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTussilago farfara Ref.
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