input word = C00002347

Metabolite InformationStructural formula
Name Lilaline
Formula C20H17NO7
Mw 383.10050191
CAS RN 110011-49-9
C_ID C00002347 ,
InChIKey YDCRQLJCXBNURP-UHFFFAOYNA-N
InChICode InChI=1S/C20H17NO7/c1-8-6-11(21-20(8)27)14-12(23)7-13(24)15-16(25)17(26)18(28-19(14)15)9-2-4-10(22)5-3-9/h2-5,7-8,11,22-24,26H,6H2,1H3,(H,21,27)/t8-,11-/m1/s1
SMILES c1(cc(c2c(c1[C@H]1C[C@H](C(=O)N1)C)oc(c(c2=O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeLiliaceaeLilium candidum Ref.
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OrganismLilium candidum
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter31