input word = C00031769

Metabolite InformationStructural formula
Name Epinodosin
Formula C20H26O6
Mw 362.17293856
CAS RN 20086-60-6
C_ID C00031769 ,
InChIKey WZYJEEIAFBHYJS-UHFFFAOYNA-N
InChICode InChI=1S/C20H26O6/c1-9-10-6-11(21)13-19(7-10,15(9)22)17(24)26-12-4-5-18(2,3)14-16(23)25-8-20(12,13)14/h10-14,16,21,23H,1,4-8H2,2-3H3/t10-,11-,12+,13+,14-,16-,19+,20+/m1/s1
SMILES C=C1C(=O)C23CC1CC(O)C2C12COC(O)C1C(C)(C)CCC2OC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon rubescens var. lushanensis Ref.
PlantaeLabiataeIsodon sculponeatus Ref.
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