input word = C00060463

Metabolite InformationStructural formula
Name Mucic acid 2,5-di-O-gallate
Formula C20H18O16
Mw 514.05948453
CAS RN 1801869-62-4
C_ID C00060463
InChIKey XAOYGJVBCOGQOF-SYMSYNOKNA-N
InChICode InChI=1/C20H18O16/c21-7-1-5(2-8(22)11(7)25)19(33)35-15(17(29)30)13(27)14(28)16(18(31)32)36-20(34)6-3-9(23)12(26)10(24)4-6/h1-4,13-16,21-28H,(H,29,30)(H,31,32)/t13-,14+,15+,16-
SMILES O=C(OC(C(=O)O)C(O)C(O)C(OC(=O)c1cc(O)c(O)c(O)c1)C(=O)O)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhyllanthaceaePhyllanthus emblica Ref.
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