input word = C00010186

Metabolite InformationStructural formula
Name Trifolirhizin
Sophojaponicin B1
(-)-Maackiain 3-O-glucoside
Formula C22H22O10
Mw 446.12129692
CAS RN 6807-83-6
C_ID C00010186 ,
InChIKey VGSYCWGXBYZLLE-JSYCUEOGNA-N
InChICode InChI=1S/C22H22O10/c23-6-17-18(24)19(25)20(26)22(32-17)30-9-1-2-10-13(3-9)27-7-12-11-4-15-16(29-8-28-15)5-14(11)31-21(10)12/h1-5,12,17-26H,6-8H2/t12-,17+,18+,19-,20+,21-,22+/m0/s1
SMILES O(c1cc2c([C@H]3[C@@H](CO2)c2c(O3)cc3c(c2)OCO3)cc1)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeBaptisia australis Ref.
PlantaeFabaceaeCicer spp. Ref.
PlantaeFabaceaeEuchresta formosana Ref.
PlantaeFabaceaeEuchresta japonica Ref.
PlantaeFabaceaeGlycyrrhiza pallidiflora Ref.
PlantaeFabaceaeOnonis spinosa Ref.
PlantaeFabaceaeSophora flavescens Ref.
PlantaeFabaceaeSophora subprostrata Ref.
PlantaeFabaceaeTephrosia spp. Ref.
PlantaeFabaceaeThermopsis spp. Ref.
PlantaeFabaceaeTrifolium pratense Ref.
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OrganismBaptisia australis
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter38