input word = C00048052

Metabolite InformationStructural formula
Name Pestaloficiol H
Formula C16H22O4
Mw 278.15180919
CAS RN 1174415-54-3
C_ID C00048052 ,
InChIKey DVORNMLMLUVMKJ-BHNJPNLCNA-N
InChICode InChI=1S/C16H22O4/c1-9(2)5-6-10-14(19)12(17)7-11-13(18)8-16(3,4)20-15(10)11/h5-6,12,14,17,19H,7-8H2,1-4H3/b10-6-/t12-,14+/m0/s1
SMILES CC(C)=C/C=C1C2=C(C[C@H](O)[C@@H]1O)C(=O)CC(C)(C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiAmphisphaeriaceaePestalotiopsis fici Ref.
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