input word = C00004113

Metabolite InformationStructural formula
Name Chrysin 7-rutinoside
Formula C27H30O13
Mw 562.16864105
CAS RN 35775-52-1
C_ID C00004113 ,
InChIKey QNFMEZGAYVOUCH-SFBAPYELNA-N
InChICode InChI=1S/C27H30O13/c1-11-20(30)22(32)24(34)26(37-11)36-10-18-21(31)23(33)25(35)27(40-18)38-13-7-14(28)19-15(29)9-16(39-17(19)8-13)12-5-3-2-4-6-12/h2-9,11,18,20-28,30-35H,10H2,1H3/t11-,18-,20+,21-,22+,23+,24-,25-,26-,27-/m1/s1
SMILES CC1O[C@@H](OCC2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccccc5)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
PlantaeBignoniaceaeDolichandrone falcata Ref.
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