input word = C00011790

Metabolite InformationStructural formula
Name Hiyodorilactone E
Santhemoidin C
Formula C22H28O8
Mw 420.17841787
CAS RN 72493-41-5
C_ID C00011790 ,
InChIKey OWLQZICLPSGTPU-XFCWPUTINA-N
InChICode InChI=1S/C22H28O8/c1-12-5-6-17(25)13(2)10-19-20(14(3)21(26)29-19)18(9-12)30-22(27)16(7-8-23)11-28-15(4)24/h5,7,10,17-20,23,25H,3,6,8-9,11H2,1-2,4H3/b12-5+,13-10+,16-7+/t17-,18-,19+,20-/m1/s1
SMILES C=C1C(=O)O[C@@H]2/C=C(C)C(O)C/C=C(C)C[C@@H](OC(=O)/C(=C/CO)COC(C)=O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium glehnii Ref.
PlantaeAsteraceaeEupatorium sachalinense Ref.
PlantaeAsteraceaeSchkuhria anthemoides Ref.
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