input word = C00007705

Metabolite InformationStructural formula
Name Cinevanine
Formula C23H30N2O5
Mw 414.21547208
CAS RN 34221-21-1
C_ID C00007705 ,
InChIKey AMMMAZLQEYJIKN-KGSKRRAHNA-N
InChICode InChI=1S/C23H30N2O5/c1-29-21-10-14(5-6-20(21)26)23(28)30-17-7-8-24-12-15-9-16(19(24)11-17)13-25-18(15)3-2-4-22(25)27/h5-6,10,15-19,26H,2-4,7-9,11-13H2,1H3/t15-,16-,17+,18-,19+/m1/s1
SMILES C1CC(=O)N2[C@H](C1)[C@@H]1C[C@H](C2)[C@H]2N(C1)CC[C@@H](C2)OC(=O)c1ccc(c(c1)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
PlantaeFabaceaeRothia hirsuta Ref.
PlantaeFabaceaeRothia trifoliata Ref.
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