input word = C00030937

Metabolite InformationStructural formula
Name Pd-II
(+)-Pareruptorin B
Formula C24H26O7
Mw 426.16785319
CAS RN 73069-28-0
C_ID C00030937 ,
InChIKey PNTWXEIQXBRCPS-VMAYOGSGNA-N
InChICode InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/b13-7-,14-8-/t20-,21-/m0/s1
SMILES c12c(ccc3c1[C@@H]([C@@H](C(O3)(C)C)OC(=O)/C(=C\C)/C)OC(=O)/C(=C\C)/C)ccc(=O)o2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePeucedanum praeruptorum DUNN. Ref.
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