input word = C00006155

Metabolite InformationStructural formula
Name Volubilinin
Formula C23H24O11
Mw 476.13186161
CAS RN 58930-58-8
C_ID C00006155 ,
InChIKey BLIRHCSFBFMKSD-VGEZFVLJNA-N
InChICode InChI=1S/C23H24O11/c1-31-10-5-3-9(4-6-10)11-8-33-21-13(15(11)25)17(27)23(32-2)18(28)14(21)22-20(30)19(29)16(26)12(7-24)34-22/h3-6,8,12,16,19-20,22,24,26-30H,7H2,1-2H3/t12-,16-,19+,20-,22+/m1/s1
SMILES c1(c(c(c2c(c1[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)occ(c2=O)c1ccc(cc1)OC)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDalbergia volubilis Ref.
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