input word = C00006174

Metabolite InformationStructural formula
Name Mirificin
Formula C26H28O13
Mw 548.15299098
CAS RN 103654-50-8
C_ID C00006174 ,
InChIKey ZBXWGKPUSLRPHX-MKZBRINPNA-N
InChICode InChI=1S/C26H28O13/c27-9-26(35)10-38-25(24(26)34)37-8-16-19(31)20(32)21(33)23(39-16)17-15(29)6-5-13-18(30)14(7-36-22(13)17)11-1-3-12(28)4-2-11/h1-7,16,19-21,23-25,27-29,31-35H,8-10H2/t16-,19+,20-,21+,23-,24-,25+,26-/m0/s1
SMILES O=c1c(-c2ccc(O)cc2)coc2c([C@@H]3O[C@@H](CO[C@@H]4OC[C@@](O)(CO)C4O)[C@@H](O)C(O)C3O)c(O)ccc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePueraria candollei var. mirifica Ref.
PlantaeFabaceaePueraria lobata Ref.
PlantaeFabaceaePueraria mirifica Ref.
PlantaeFabaceaePueraria montana var. lobata Ref.
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