input word = C00004125

Metabolite InformationStructural formula
Name Palustrinoside
Formula C22H20O11
Mw 460.10056148
CAS RN 29673-46-9
C_ID C00004125 ,
InChIKey RXOPIWRTYRCEMW-JNFAVNEGNA-N
InChICode InChI=1S/C22H20O11/c1-30-13-8-12-14(10(23)7-11(31-12)9-5-3-2-4-6-9)19(15(13)24)32-22-18(27)16(25)17(26)20(33-22)21(28)29/h2-8,16-18,20,22,24-27H,1H3,(H,28,29)/t16-,17-,18+,20+,22+/m0/s1
SMILES COc1cc2oc(-c3ccccc3)cc(=O)c2c(O[C@@H]2OC(C(=O)O)[C@@H](O)[C@H](O)C2O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEquisetaceaeEquisetum palustre Ref.
PlantaeLabiataeStachys palustris Ref.
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