input word = C00002022

Metabolite InformationStructural formula
Name Astrophylline
Formula C19H26N2O
Mw 298.20451347
CAS RN 5081-53-8
C_ID C00002022 ,
InChIKey XIZYLQMCWHMQNP-TZXKNOGBNA-N
InChICode InChI=1S/C19H26N2O/c22-19(12-11-16-7-2-1-3-8-16)21-14-6-9-17(15-21)18-10-4-5-13-20-18/h1-3,7-8,11-12,17-18,20H,4-6,9-10,13-15H2/b12-11-/t17-,18-/m1/s1
SMILES C1N[C@H](CCC1)[C@H]1CN(CCC1)C(=O)/C=C\c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-Lys L-Asp
Organism
Kingdom Family Species Reference
PlantaePhyllanthaceaeAstrocasia phyllantoides Ref.
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