input word = C00003272

Metabolite InformationStructural formula
Name Euparotin
Formula C20H24O7
Mw 376.15220312
CAS RN 10191-01-2
C_ID C00003272 ,
InChIKey ADBOAFOIAMBXJT-JSWXHYFPNA-N
InChICode InChI=1S/C20H24O7/c1-5-9(2)17(22)26-13-7-19(8-25-19)15-12(21)6-10(3)20(15,24)16-14(13)11(4)18(23)27-16/h5-6,12-16,21,24H,4,7-8H2,1-3H3/b9-5-/t12-,13+,14+,15-,16-,19-,20+/m0/s1
SMILES [C@@H]12[C@@]([C@@H]3[C@@H]([C@@H](C[C@]41OC4)OC(=O)/C(=C\C)/C)C(=C)C(=O)O3)(C(=C[C@@H]2O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentaurea aggregata Ref.
PlantaeAsteraceaeEupatorium rotundifolium Ref.
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