input word = C00031073

Metabolite InformationStructural formula
Name Polystachyne F
Formula C20H20O6
Mw 356.12598837
CAS RN 917476-05-2
C_ID C00031073 ,
InChIKey MWPURVLYOLKTOU-IHWYPQMZNA-N
InChICode InChI=1S/C20H20O6/c1-10-15-6-12-9-23-18(21)13(12)2-3-14-17(24-14)20(10)7-16(26-19(20)25-15)11-4-5-22-8-11/h2-5,8,10,14-17,19H,6-7,9H2,1H3/b3-2-/t10-,14-,15-,16+,17-,19+,20+/m1/s1
SMILES C1(=O)OCC2=C1/C=C\[C@@H]1[C@H]([C@]34[C@@H]([C@@H](C2)O[C@H]3O[C@@H](C4)c2ccoc2)C)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia polystachya Ref.
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OrganismSalvia polystachya
ReferenceOrtega,Chem.Pharm.Bull.,54,(2006),1338