input word = C00060605

Metabolite InformationStructural formula
Name 2,3,4,5-Tetrahydro-7,8-dihydroxy-3,5-dioxo-9-(sulfooxy)-1H-benz[e]indene-1-carboxylic acid
Formula C14H10O10S1-
Mw 369.99946727
CAS RN 193484-87-6
C_ID C00060605
InChIKey GWPFEEREIYZBSG-UHFFFAOYSA-N
InChICode InChI=1S/C14H10O10S.K/c15-7-1-4-8(16)3-6(14(19)20)10(4)11-5(7)2-9(17)12(18)13(11)24-25(21,22)23;/h2,6,17-18H,1,3H2,(H,19,20)(H,21,22,23);
SMILES O=C1CC(C(=O)O)C2=C1CC(=O)c1cc(O)c(O)c(OS(=O)(=O)O)c12.[K]
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLythraceaePunica granatum Ref.
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