input word = C00021455

Metabolite InformationStructural formula
Name Armillaric acid
Formula C23H28O7
Mw 416.18350325
CAS RN 129251-06-5
C_ID C00021455 ,
InChIKey AOCKXACXCVTXBB-GAZHASMVNA-N
InChICode InChI=1S/C23H28O7/c1-11-5-13(24)7-16(25)18(11)20(28)30-17-10-22(4)15-9-21(2,3)8-12(15)6-14(19(26)27)23(17,22)29/h5-7,12,15,17,24-25,29H,8-10H2,1-4H3,(H,26,27)/t12-,15-,17+,22+,23?/m0/s1
SMILES C1(=C[C@@H]2[C@@H]([C@@]3([C@]1([C@@H](C3)OC(=O)c1c(cc(cc1C)O)O)O)C)CC(C2)(C)C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeArmillaria mellea Ref.
zoom in