input word = C00033801

Metabolite InformationStructural formula
Name Effuside IV
Formula C23H28O8
Mw 432.17841787
CAS RN 169238-37-3
C_ID C00033801 ,
InChIKey DLRPMPPEDKOOAS-OKSJBWTQNA-N
InChICode InChI=1S/C23H28O8/c1-10-14-4-3-13-11(2)17(6-5-15(13)19(14)12(8-24)7-16(10)26)30-23-22(29)21(28)20(27)18(9-25)31-23/h5-7,18,20-29H,3-4,8-9H2,1-2H3/t18-,20+,21+,22-,23-/m1/s1
SMILES c12c(CCc3c1ccc(c3C)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)c(c(cc2CO)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeJuncaceaeJuncus effusus Ref.
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OrganismJuncus effusus
ReferenceKovacs,Phytochem.,69,(2008),1084