input word = C00042173

Metabolite InformationStructural formula
Name 7beta-Hydroxycatuabine I
Formula C14H20N2O4
Mw 280.14230714
CAS RN 864962-35-6
C_ID C00042173 ,
InChIKey MVCDWVMMIFQPIY-DERRMCRCNA-N
InChICode InChI=1S/C14H20N2O4/c1-15-5-3-4-9(15)14(19)20-8-6-10-12(17)13(18)11(7-8)16(10)2/h3-5,8,10-13,17-18H,6-7H2,1-2H3/t8-,10-,11+,12-,13-/m0/s1
SMILES [C@H]1([C@H]([C@H]2C[C@H](C[C@@H]1N2C)OC(=O)c1cccn1C)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeErythroxylaceaeErythroxylum vacciniifolium Ref.
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