input word = C00037273

Metabolite InformationStructural formula
Name Holocalin
Formula C14H17NO7
Mw 311.10050191
CAS RN 41753-54-2
C_ID C00037273 ,
InChIKey KCVXNPDAHDGXFD-KUEUEWHGNA-N
InChICode InChI=1S/C14H17NO7/c15-5-9(7-2-1-3-8(17)4-7)21-14-13(20)12(19)11(18)10(6-16)22-14/h1-4,9-14,16-20H,6H2/t9-,10+,11+,12-,13+,14+/m0/s1
SMILES N#C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cccc(O)c1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeSambucus nigra Ref.
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