input word = C00047231

Metabolite InformationStructural formula
Name Eubotriol
Formula C20H32O3
Mw 320.23514489
CAS RN 42932-76-3
C_ID C00047231 ,
InChIKey SMJRKTGCQAVGTN-CDYUPZGZNA-N
InChICode InChI=1S/C20H32O3/c1-12-13-5-6-14-19(3)8-4-7-18(2,11-21)15(19)9-16(22)20(14,10-13)17(12)23/h13-17,21-23H,1,4-11H2,2-3H3/t13-,14+,15-,16+,17+,18-,19+,20-/m1/s1
SMILES C1[C@@H]2[C@]3(C[C@@H](C1)C(=C)[C@@H]3O)[C@H](C[C@H]1[C@]2(CCC[C@@]1(CO)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSideritis arguta Ref.
PlantaeLabiataeSideritis euboea Ref.
zoom in