input word = C00046266

Metabolite InformationStructural formula
Name Pachyclavulariaenone G
Formula C20H30O6
Mw 366.20423869
CAS RN 473882-82-5
C_ID C00046266 ,
InChIKey XIBRAFVSCLBFNY-UHFFFAOYNA-N
InChICode InChI=1S/C20H30O6/c1-9-5-11(21)15-10(2)8-25-20(4)14(23)6-13(22)19(3,24)7-12-16(9)17(15)18(20)26-12/h5,10,12-18,22-24H,6-8H2,1-4H3/t10-,12+,13-,14-,15-,16-,17-,18+,19-,20+/m1/s1
SMILES [C@]1(C[C@H]2[C@H]3C(=CC(=O)[C@@H]4[C@H]3[C@@H]([C@@](OC[C@H]4C)([C@@H](C[C@H]1O)O)C)O2)C)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Pachyclavularia violacea Ref.
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OrganismPachyclavularia violacea
ReferenceWang,J.Nat.Prod.,65,(2002),1475