input word = C00054971

Metabolite InformationStructural formula
Name Arabinopyranose cyclic 3,4-(4,4',5,5',6,6'-hexahydroxydiphenate)
Formula C19H16O13
Mw 452.0590906
CAS RN 19833-16-0
C_ID C00054971
InChIKey ZKBLUASIGJJVPP-FZAJJURZSA-N
InChICode InChI=1S/C19H16O13/c20-6-1-4-9(13(24)11(6)22)10-5(2-7(21)12(23)14(10)25)18(28)32-16-8(31-17(4)27)3-30-19(29)15(16)26/h1-2,8,15-16,19-26,29H,3H2/t8-,15+,16-,19?/m0/s1
SMILES O=C1O[C@@]([C@@H](O)C(O)OC2)([H])[C@@]2([H])OC(C(C=C(O)C(O)=C3O)=C3C4=C1C=C(O)C(O)=C4O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrtaceaePsidium guajava Ref.
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