input word = C00006607

Metabolite InformationStructural formula
Name alpha-Diceroptene
Formula C36H36O8
Mw 596.24101813
CAS RN 98094-16-7
C_ID C00006607 ,
InChIKey GYWZFQXCWYAZDN-ZVTZDLPXNA-N
InChICode InChI=1S/C36H36O8/c1-35(2)23(43-5)17-21(37)27(33(35)41)31(39)29-25(19-13-9-7-10-14-19)30(26(29)20-15-11-8-12-16-20)32(40)28-22(38)18-24(44-6)36(3,4)34(28)42/h7-18,25-26,29-30,37-38H,1-6H3/t25-,26+,29-,30-
SMILES [C@H]1([C@H]([C@H]([C@H]1c1ccccc1)C(=O)C1=C(C=C(C(C1=O)(C)C)OC)O)c1ccccc1)C(=O)C1=C(C=C(C(C1=O)(C)C)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaePityrogramma triangularis Ref.
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