input word = C00055258

Metabolite InformationStructural formula
Name 1,2'-Di-O-galloylhamamelofuranose
Formula C20H20O14
Mw 484.08530535
CAS RN 90275-98-2
C_ID C00055258
InChIKey YLVZUMVQGWGBQX-GVONYJOWSA-N
InChICode InChI=1S/C20H20O14/c21-5-13-16(28)20(31,6-32-17(29)7-1-9(22)14(26)10(23)2-7)19(33-13)34-18(30)8-3-11(24)15(27)12(25)4-8/h1-4,13,16,19,21-28,31H,5-6H2/t13-,16+,19?,20+/m0/s1
SMILES O=C(OC[C@]1(O)C(OC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](CO)[C@H]1O)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFagaceaeCastanea crenata Ref.
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