input word = C00021471

Metabolite InformationStructural formula
Name Armillyl everninate
Formula C24H32O6
Mw 416.21988875
CAS RN 102092-44-4
C_ID C00021471 ,
InChIKey KIBURFBDQVFUHO-NNQSPVHCNA-N
InChICode InChI=1S/C24H32O6/c1-12-6-13(29-5)7-17(26)19(12)22(28)30-18-10-24(4)16-9-23(2,3)8-14(16)21(27)15(11-25)20(18)24/h6-7,14,16,18,21,25-27H,8-11H2,1-5H3/t14-,16+,18-,21+,24-/m1/s1
SMILES C1(=C2[C@@]([C@@H]3[C@H]([C@@H]1O)CC(C3)(C)C)(C[C@H]2OC(=O)c1c(cc(cc1O)OC)C)C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeArmillaria mellea Ref.
zoom in