input word = C00037665

Metabolite InformationStructural formula
Name Polygalaxanthone III
Formula C25H28O15
Mw 568.14282023
CAS RN 162857-78-5
C_ID C00037665 ,
InChIKey LLJUCXMVRPAONX-UIUBKXHRNA-N
InChICode InChI=1S/C25H28O15/c1-36-12-2-8-11(3-9(12)27)39-13-4-10(28)15(19(31)16(13)17(8)29)22-21(33)20(32)18(30)14(40-22)5-37-24-23(34)25(35,6-26)7-38-24/h2-4,14,18,20-24,26-28,30-35H,5-7H2,1H3/t14-,18-,20+,21-,22+,23+,24-,25-/m1/s1
SMILES c12c(oc3c(c1=O)c(c(c(c3)O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@@H]1OC[C@]([C@H]1O)(O)CO)O)O)O)O)cc(c(c2)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaePolygala sibirica Ref.
PlantaePolygalaceaePolygala tenuifolia Willd. Ref.
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OrganismPolygala tenuifolia Willd.
ReferenceJiang,Phytochem.,60,(2002),813