input word = C00012965

Metabolite InformationStructural formula
Name 1-Epierivanin
(11S)-1beta,3alpha,6alpha-trihydroxyeudesm-4(14)-en-12-oic acid gamma-lactone
Formula C15H22O4
Mw 266.15180919
CAS RN 32203-46-6
C_ID C00012965 ,
InChIKey PFDGLXOOSQNAKH-RSNCILCUNA-N
InChICode InChI=1S/C15H22O4/c1-7-9-4-5-15(3)11(17)6-10(16)8(2)12(15)13(9)19-14(7)18/h7,9-13,16-17H,2,4-6H2,1,3H3/t7-,9-,10+,11+,12+,13-,15-/m0/s1
SMILES C1C[C@@H]2[C@@H]([C@@H]3[C@@]1([C@@H](C[C@H](C3=C)O)O)C)OC(=O)[C@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelminthotheca aculeata (Vahl) Lack Ref.
PlantaeAsteraceaePicris aculeata Ref.
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OrganismHelminthotheca aculeata (Vahl) Lack
ReferenceZidorn,Phytochem.,69,(2008),2270