input word = C00040548

Metabolite InformationStructural formula
Name Tricalysiamide C
Formula C21H31NO4
Mw 361.22530849
CAS RN 938050-31-8
C_ID C00040548 ,
InChIKey KTNZRKKLKVMLHB-YHTQEBFUNA-N
InChICode InChI=1S/C21H31NO4/c1-18-7-8-21(26-2)15(9-17(24)22-21)14(18)5-6-19-10-13(3-4-16(18)19)20(25,11-19)12-23/h9,13-14,16,23,25H,3-8,10-12H2,1-2H3,(H,22,24)/t13-,14-,16-,18-,19+,20+,21+/m1/s1
SMILES CO[C@@]12CC[C@]3(C)[C@H](CC[C@@]45C[C@@H](CC[C@H]43)[C@@](O)(CO)C5)C1=CC(=O)N2
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeTricalysia dubia Ref.
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