input word = C00016866

Metabolite InformationStructural formula
Name 3097B2
Formula C14H19NO4
Mw 265.1314081
CAS RN 139755-63-8
C_ID C00016866 ,
InChIKey NXNBOAUSGYFPGB-UHFFFAOYNA-N
InChICode InChI=1S/C14H19NO4/c1-2-13(18)19-14-11(15-8-12(14)17)7-9-3-5-10(16)6-4-9/h3-6,11-12,14-17H,2,7-8H2,1H3/t11-,12-,14-/m1/s1
SMILES CCC(=O)OC1C(O)CNC1Cc1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces SA3097 Ref.
zoom in