input word = C00010112

Metabolite InformationStructural formula
Name Biochanin A 7-O-glucoside
Astroside
Sissotrin
Formula C22H22O10
Mw 446.12129692
CAS RN 5928-26-7
C_ID C00010112 ,
InChIKey LFEUICHQZGNOHD-RSBVYOOMNA-N
InChICode InChI=1S/C22H22O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3/t16-,19-,20+,21-,22-/m1/s1
SMILES O(c1cc2c(c(=O)c(co2)c2ccc(cc2)OC)c(c1)O)[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
PlantaeFabaceaeCicer arietinum Ref.
PlantaeFabaceaeMedicago truncatula Ref.
PlantaeFabaceaeSophora japonica L. Ref.
PlantaeFabaceaeTrifolium pratense Ref.
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