input word = C00032952

Metabolite InformationStructural formula
Name Eupaglehnin A
(+)-Eupaglehnin A
Formula C21H28O6
Mw 376.18858863
CAS RN 476630-48-5
C_ID C00032952 ,
InChIKey OTWFEXKPUVHGDY-MZYKVIIONA-N
InChICode InChI=1S/C21H28O6/c1-13-6-5-7-14(2)11-18(19-15(3)20(23)26-17(19)10-13)27-21(24)16(8-9-22)12-25-4/h7-8,10,17-19,22H,3,5-6,9,11-12H2,1-2,4H3/b13-10+,14-7-,16-8+/t17-,18+,19?/m0/s1
SMILES C1/C=C(\C[C@H]([C@@H]2[C@H](/C=C(/C1)\C)OC(=O)C2=C)OC(=O)/C(=C/CO)/COC)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium glehnii Ref.
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