input word = C00007971

Metabolite InformationStructural formula
Name Piperaduncin A
Formula C29H30O7
Mw 490.19915331
CAS RN 155023-54-4
C_ID C00007971 ,
InChIKey UWDJCYWVPNETPR-UHFFFAOYNA-N
InChICode InChI=1S/C29H30O7/c1-17(2)14-21(20-15-19(29(34)36-4)11-13-22(20)30)26-25(35-3)16-24(32)27(28(26)33)23(31)12-10-18-8-6-5-7-9-18/h5-9,11,13-16,21,30,32-33H,10,12H2,1-4H3/t21-/m1/s1
SMILES c1(cc(c(c(c1[C@@H](c1c(ccc(c1)C(=O)OC)O)C=C(C)C)O)C(=O)CCc1ccccc1)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper aduncum Ref.
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