input word = C00055507

Metabolite InformationStructural formula
Name Armillaricin
Formula C24H29ClO5
Mw 432.17035175
CAS RN 119516-62-0
C_ID C00055507
InChIKey YXCHOGCORJTWJY-RLJZQAMKSA-N
InChICode InChI=1S/C24H27ClO5/c1-12-6-16(29-5)20(25)21(27)18(12)22(28)30-17-10-24(4)15-9-23(2,3)8-13(15)7-14(11-26)19(17)24/h6-7,11,15,17,27H,8-10H2,1-5H3/t15-,17+,24+/m1/s1
SMILES COC1=C(Cl)C(O)=C(C(O[C@H]2C[C@]3(C)C2=C(C=O)C=C4[C@@]3([H])CC(C)(C)C4)=O)C(C)=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeArmillaria mellea Ref.
zoom in