input word = C00045696

Metabolite InformationStructural formula
Name Brachystemidine C
(-)-Brachystemidine C
Formula C15H18N2O6
Mw 322.11648632
CAS RN 436807-94-2
C_ID C00045696 ,
InChIKey XXNXFWDNPYKFDJ-UHFFFAOYNA-N
InChICode InChI=1S/C15H18N2O6/c1-21-12-7-11(18)13(19)17(12)14-9(4-6-22-14)8-23-15(20)10-3-2-5-16-10/h2-5,11-12,14,16,18H,6-8H2,1H3/t11-,12-,14-/m0/s1
SMILES O1CC=C([C@H]1N1[C@H](C[C@@H](C1=O)O)OC)COC(=O)c1ccc[nH]1
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeBrachystemma calycinum Ref.
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