input word = C00012006

Metabolite InformationStructural formula
Name Saussurea lactone
(all-S)-Hexahydro-7-isopropenyl-3,6-dimethyl-6-vinyl-2(3H)-benzofuranone
Formula C15H22O2
Mw 234.16197995
CAS RN 23527-07-3
C_ID C00012006 ,
InChIKey LMNJALUUIMXUQQ-NQBKCUCCNA-N
InChICode InChI=1S/C15H22O2/c1-6-15(5)8-7-11-10(4)14(16)17-13(11)12(15)9(2)3/h6,10-13H,1-2,7-8H2,3-5H3/t10-,11-,12+,13+,15+/m0/s1
SMILES C1[C@@H]2[C@H]([C@H]([C@@](C1)(C=C)C)C(=C)C)OC(=O)[C@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSaussurea lappa Ref.
PlantaeJubulaceaeFrullania rostrata Ref.
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OrganismSaussurea lappa
ReferenceRao,Tetrahedron,13,(1961),319