input word = C00039969

Metabolite InformationStructural formula
Name Pestafolide A
(-)-Pestafolide A
Formula C15H22O5
Mw 282.14672381
CAS RN 1015244-99-1
C_ID C00039969 ,
InChIKey BKSQJYOLLWNPIP-UVNDGPADNA-N
InChICode InChI=1S/C15H22O5/c1-9-4-3-5-15(20-9)7-10-6-12(16)14(2,18)13(17)11(10)8-19-15/h9,12,16,18H,3-8H2,1-2H3/t9-,12-,14+,15-/m0/s1
SMILES C[C@H]1CCC[C@@]2(CC3=C(CO2)C(=O)[C@](C)(O)[C@@H](O)C3)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiAmphisphaeriaceaePestalotiopsis foedan Ref.
FungiAmphisphaeriaceaePestalotiopsis foedans Ref.
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