input word = C00033505

Metabolite InformationStructural formula
Name (7R,8R)-Petranine
Formula C14H20NO3
Mw 250.14431851
CAS RN 1068120-87-5
C_ID C00033505 ,
InChIKey LCJIMXGKKRDCFW-MCPLIGNDNA-N
InChICode InChI=1S/C14H20NO3/c1-3-10(2)14(16)17-8-11-4-6-15-7-5-12(13(11)15)18-9-15/h3-4,12-13H,5-9H2,1-2H3/q+1/b10-3-/t12-,13-,15-/m1/s1
SMILES [C@H]12[N@@+]3(CC[C@H]1OC3)CC=C2COC(=O)/C(=C\C)/C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeEchium glomeratum Ref.
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