input word = C00010248

Metabolite InformationStructural formula
Name 5,7,3',4'-Tetrahydroxy-4-phenylcoumarin 5-O-glucoside
Formula C21H20O11
Mw 448.10056148
CAS RN 116329-89-6
C_ID C00010248 ,
InChIKey VAPVFWUBNBLVMB-NXBQWJJBNA-N
InChICode InChI=1S/C21H20O11/c22-7-15-18(27)19(28)20(29)21(32-15)31-14-5-9(23)4-13-17(14)10(6-16(26)30-13)8-1-2-11(24)12(25)3-8/h1-6,15,18-25,27-29H,7H2/t15-,18-,19+,20-,21-/m1/s1
SMILES O=c1cc(-c2ccc(O)c(O)c2)c2c(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)cc(O)cc2o1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeCoutarea hexandra Ref.
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