input word = C00033081

Metabolite InformationStructural formula
Name Jatamansin
Secryptotaenin A
Selenedin
Selinidin
Formula C19H20O5
Mw 328.13107375
CAS RN 19427-82-8
C_ID C00033081 ,
InChIKey RRHCDWLSHIIIIT-ORKQHQMHNA-N
InChICode InChI=1S/C19H20O5/c1-5-11(2)18(21)22-15-10-13-14(24-19(15,3)4)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5-/t15-/m0/s1
SMILES c12c(ccc3c1C[C@@H](C(O3)(C)C)OC(=O)/C(=C\C)/C)ccc(=O)o2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeLigusticum elatum Ref.
PlantaeApiaceaeLomatium columbianum Ref.
PlantaeApiaceaeNiphogeton ternata Ref.
PlantaeApiaceaePrionosciadium thapsoides Ref.
PlantaeApiaceaeSelinum vaginatum Ref.
PlantaeValerianaceaeNardostachys chinensis Ref.
PlantaeValerianaceaeNardostachys jatamansi Ref.
--Libanotis buchtormensis Ref.
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OrganismPrionosciadium thapsoides
ReferenceTorres-Valencia,J.Nat.Prod.,71,(2008),1956