input word = C00001549

Metabolite InformationStructural formula
Name Octopine
Formula C9H18N4O4
Mw 246.13280509
CAS RN 34522-32-2
C_ID C00001549 ,
InChIKey IMXSCCDUAFEIOE-MZQZIECVNA-N
InChICode InChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12)/t5-,6+/m1/s1
SMILES OC(=O)[C@H](CCCNC(=N)N)N[C@H](C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
PlantaeFabaceaePhaseolus vulgaris Ref.
-- Ref.
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