input word = C00004362

Metabolite InformationStructural formula
Name 5,7,3'-Trihydroxy-4'-methoxyflavone 7-O-rutinoside
Diosmin
Luteolin 4'-methyl ether 7-rutinoside
Formula C28H32O15
Mw 608.17412036
CAS RN 520-27-4
C_ID C00004362 ,
InChIKey GZSOSUNBTXMUFQ-GLOFBDNXNA-N
InChICode InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3/t10-,19+,21-,22+,23-,24-,25+,26+,27+,28+/m0/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1ccc(c(c1)O)OC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeDahlia variabilis Ref.
PlantaeCaryophyllaceaePratia nummularia Ref.
PlantaeCrassulaceaeBryophyllum pinnatum Ref.
PlantaeFabaceaeSophora davidii Ref.
PlantaeFabaceaeSophora microphylla Ref.
PlantaeFabaceaeVicia cracca Ref.
PlantaeRutaceaeCitrus limon Ref.
PlantaeRutaceaeCitrus reticulata Ref.
PlantaeRutaceaeDiosma crenulata Ref.
PlantaeTaxaceaeTaxus chinensis Ref.
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