input word = C00039279

Metabolite InformationStructural formula
Name Glucoacetosyringone
Formula C16H22O9
Mw 358.1263823
CAS RN 86402-41-7
C_ID C00039279 ,
InChIKey NUZMLNQKLRRREC-UCSOOTJHNA-N
InChICode InChI=1S/C16H22O9/c1-7(18)8-4-9(22-2)15(10(5-8)23-3)25-16-14(21)13(20)12(19)11(6-17)24-16/h4-5,11-14,16-17,19-21H,6H2,1-3H3/t11-,12-,13+,14-,16+/m1/s1
SMILES c1(cc(cc(c1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)OC)C(=O)C)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeStachys lanata Ref.
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