input word = C00004135

Metabolite InformationStructural formula
Name 7,3',4'-Trihydroxyflavone 7-rutinoside
Formula C27H30O14
Mw 578.16355567
CAS RN 27576-42-7
C_ID C00004135 ,
InChIKey XEGFGSKULOVWMZ-LGWNNUJSNA-N
InChICode InChI=1S/C27H30O14/c1-10-20(31)22(33)24(35)26(38-10)37-9-19-21(32)23(34)25(36)27(41-19)39-12-3-4-13-15(29)8-17(40-18(13)7-12)11-2-5-14(28)16(30)6-11/h2-8,10,19-28,30-36H,9H2,1H3/t10-,19-,20+,21-,22+,23+,24+,25-,26-,27-/m1/s1
SMILES CC1O[C@@H](OCC2O[C@@H](Oc3ccc4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)C(O)[C@@H](O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeBaptisia perfoliata Ref.
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