input word = C00022300

Metabolite InformationStructural formula
Name Barbatol
Tarapacol
Formula C20H36O3
Mw 324.26644502
CAS RN 57129-38-1
C_ID C00022300 ,
InChIKey KYTFZACHEUSLEA-AURXUATNNA-N
InChICode InChI=1S/C20H36O3/c1-17(2)9-6-10-18(3)14(17)7-11-19(4)15(18)8-12-20(5,23-19)16(22)13-21/h14-16,21-22H,6-13H2,1-5H3/t14-,15+,16-,18-,19+,20-/m0/s1
SMILES C1CC([C@H]2[C@](C1)([C@@H]1[C@@](CC2)(O[C@@](CC1)([C@H](CO)O)C)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSideritis arborescens Ref.
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OrganismSideritis arborescens
ReferenceCastenn-Lichterfelde,Experientia,31,(1975),757