input word = C00010762

Metabolite InformationStructural formula
Name Isonuezhenide
Formula C31H42O17
Mw 686.24219992
CAS RN 112693-22-8
C_ID C00010762 ,
InChIKey BXFDSXRULGPMLO-OOROXEKTNA-N
InChICode InChI=1S/C31H42O17/c1-3-16-17(18(28(41)42-2)13-44-29(16)48-31-25(39)23(37)22(36)19(11-32)45-31)10-21(35)47-27-20(12-33)46-30(26(40)24(27)38)43-9-8-14-4-6-15(34)7-5-14/h3-7,13,17,19-20,22-27,29-34,36-40H,8-12H2,1-2H3/b16-3+/t17-,19+,20+,22+,23-,24-,25-,26-,27+,29-,30+,31-/m0/s1
SMILES [C@H]1(O[C@@H]([C@H]([C@H]([C@@H]1O)O)OC(=O)C[C@@H]1C(=CO[C@@H](O[C@@H]2O[C@@H]([C@H]([C@@H]([C@@H]2O)O)O)CO)/C/1=C/C)C(=O)OC)CO)OCCc1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeLigustrum japonicum Ref.
PlantaeOleaceaeLigustrum lucidum Ref.
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