input word = C00037049

Metabolite InformationStructural formula
Name Dicliripariside B
(-)-Dicliripariside B
Formula C31H36O16
Mw 664.20033511
CAS RN 491613-66-2
C_ID C00037049 ,
InChIKey ISVJQJMGKFYXBW-GFPJZFSYNA-N
InChICode InChI=1S/C31H36O16/c1-12-27(44-13(2)32)23(36)25(38)30(43-12)42-11-20-21(34)22(35)24(37)31(47-20)46-19-9-16-17(33)10-18(14-5-7-15(40-3)8-6-14)45-28(16)26(39)29(19)41-4/h5-10,12,20-25,27,30-31,34-39H,11H2,1-4H3/t12-,20+,21-,22-,23-,24+,25+,27-,30+,31+/m0/s1
SMILES c12c(c(=O)cc(o1)c1ccc(cc1)OC)cc(c(c2O)OC)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)OC(=O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeDicliptera riparia Ref.
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OrganismDicliptera riparia
ReferenceLuo,Phytochem.,61,(2002),449