input word = C00004287

Metabolite InformationStructural formula
Name Isoscutellarein 7-O-glucoside
Isoscutellarein 7-glucoside
Formula C21H20O11
Mw 448.10056148
CAS RN 63317-86-2
C_ID C00004287 ,
InChIKey LKPJBEBGOBIWTE-OSYXLDHXNA-N
InChICode InChI=1S/C21H20O11/c22-7-14-16(26)18(28)19(29)21(32-14)31-13-6-11(25)15-10(24)5-12(30-20(15)17(13)27)8-1-3-9(23)4-2-8/h1-6,14,16,18-19,21-23,25-29H,7H2/t14-,16-,18+,19-,21-/m1/s1
SMILES c1(cc(c2c(c1O)oc(cc2=O)c1ccc(cc1)O)O)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
PlantaeLabiataeStachys alopecuros (L.) Benth. Ref.
--Bryum argenteum Ref.
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