input word = C00010165

Metabolite InformationStructural formula
Name Genistein 7-O-glucoside-4'-O-apioside
Neobacin
Formula C26H28O14
Mw 564.14790561
CAS RN 108069-00-7
C_ID C00010165 ,
InChIKey MYYACPYOKARWKL-SCGWLTPHNA-N
InChICode InChI=1S/C26H28O14/c27-7-17-20(31)21(32)22(33)24(40-17)39-13-5-15(29)18-16(6-13)36-8-14(19(18)30)11-1-3-12(4-2-11)38-25-23(34)26(35,9-28)10-37-25/h1-6,8,17,20-25,27-29,31-35H,7,9-10H2/t17-,20+,21-,22+,23+,24+,25-,26+/m0/s1
SMILES O=c1c(-c2ccc(O[C@@H]3OCC(O)(CO)[C@@H]3O)cc2)coc2cc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)cc(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeNeorautanenia amboensis Ref.
zoom in



OrganismNeorautanenia amboensis
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 517,Isoflavonoids and neoflavonoids

Breytenbach,J.Nat.Prod.,49,(1986),1003