input word = C00022375

Metabolite InformationStructural formula
Name Schkuhrianol acetate
Formula C22H36O4
Mw 364.26135964
CAS RN 78129-65-4
C_ID C00022375 ,
InChIKey QLFSWDVLYHGOBQ-UIURFQLANA-N
InChICode InChI=1S/C22H36O4/c1-15(23)25-14-22(18-13-24-18)12-8-17-20(4)10-6-9-19(2,3)16(20)7-11-21(17,5)26-22/h16-18H,6-14H2,1-5H3/t16-,17+,18+,20-,21+,22+/m1/s1
SMILES C1CC([C@@H]2[C@@](C1)([C@H]1[C@](CC2)(O[C@@](CC1)(COC(=O)C)[C@@H]1CO1)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSchkuhria multiflora Ref.
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