input word = C00012257

Metabolite InformationStructural formula
Name (+)-Montafrusin B
Montafrusin B
Formula C20H26O6
Mw 362.17293856
CAS RN 102607-36-3
C_ID C00012257 ,
InChIKey PKEFTLXVPFZWFQ-WPCYIMIHNA-N
InChICode InChI=1S/C20H26O6/c1-10(2)6-16(22)26-19-17-13(5)20(24)25-15(17)8-11(3)7-14(21)9-12(4)18(19)23/h6,8-9,14-15,17-19,21,23H,5,7H2,1-4H3/b11-8+,12-9+/t14-,15+,17-,18+,19-/m1/s1
SMILES [C@H]12[C@@H](OC(=O)C1=C)/C=C(/C[C@H](/C=C(/[C@@H]([C@@H]2OC(=O)C=C(C)C)O)\C)O)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMontanoa frutescens Ref.
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