input word = C00002469

Metabolite InformationStructural formula
Name Disenecionyl cis-khellactone
Formula C24H26O7
Mw 426.16785319
CAS RN 54676-88-9
C_ID C00002469 ,
InChIKey UHWIZIJICYWABA-VVWGFWRPNA-N
InChICode InChI=1S/C24H26O7/c1-13(2)11-18(26)29-22-20-16(9-7-15-8-10-17(25)28-21(15)20)31-24(5,6)23(22)30-19(27)12-14(3)4/h7-12,22-23H,1-6H3/t22-,23-/m1/s1
SMILES c1c2c(c3c(c1)ccc(=O)o3)[C@@H](OC(=O)C=C(C)C)[C@@H](OC(=O)C=C(C)C)C(O2)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeSeseli incanum Ref.
PlantaeApiaceaeSeseli libanotis Ref.
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