input word = C00012226

Metabolite InformationStructural formula
Name Ethoxyisorolandrolide
Formula C23H30O8
Mw 434.19406794
CAS RN 76010-18-9
C_ID C00012226 ,
InChIKey PLSSLFSHPGJMIE-DMJOVAHWNA-N
InChICode InChI=1S/C23H30O8/c1-7-28-12-17-20-18(30-22(17)26)9-14(4)8-16(29-15(5)24)10-23(6,27)11-19(20)31-21(25)13(2)3/h8-9,16,19,27H,2,7,10-12H2,1,3-6H3/b14-8+,18-9+/t16-,19+,23+/m0/s1
SMILES C=C(C)C(=O)OC1CC(C)(O)CC(OC(C)=O)/C=C(C)/C=C2/OC(=O)C(COCC)=C21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeRolandra fruticosa Ref.
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