input word = C00002318

Metabolite InformationStructural formula
Name (+)-Calycanthine
Calycanthine
Formula C22H26N4
Mw 346.21574686
CAS RN 595-05-1
C_ID C00002318 ,
InChIKey XSYCDVWYEVUDKQ-RACYZHBKNA-N
InChICode InChI=1S/C22H26N4/c1-25-13-11-22-16-8-4-5-9-17(16)23-19(25)21(22)12-14-26(2)20(22)24-18-10-6-3-7-15(18)21/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21-,22-/m1/s1
SMILES c1ccc2c(c1)[C@@]13[C@@]4([C@H](N2)N(CC3)C)c2c(N[C@@H]1N(CC4)C)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeCalycanthaceaeCalycanthus floridus Ref.
PlantaeCalycanthaceaeCalycanthus floridus var. glaucus Ref.
PlantaeCalycanthaceaeCalycanthus occidentails Ref.
PlantaeCalycanthaceaeCalycanthus occidentalis Ref.
PlantaeCalycanthaceaeCalycanthus praecox Ref.
PlantaeRubiaceaePalicourea alpina Ref.
PlantaeRubiaceaePalicourea coriacea Ref.
--Idiospermun australiense Ref.
--Meratia praecox Ref.
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OrganismPalicourea coriacea
ReferenceSilva,J.Nat.Med.,62,(2008),356