input word = C00000567

Metabolite InformationStructural formula
Name PM-toxin B
Formula C33H62O8
Mw 586.44446896
CAS RN 87879-56-9
C_ID C00000567 ,
InChIKey ISDLLJGHFWSQQK-UHFFFAOYNA-N
InChICode InChI=1S/C33H62O8/c1-3-4-8-15-28(36)23-29(37)18-11-6-12-19-32(40)25-33(41)21-14-7-13-20-31(39)24-30(38)17-10-5-9-16-27(35)22-26(2)34/h26-28,31-32,34-36,39-40H,3-25H2,1-2H3/t26-,27+,28-,31-,32+/m0/s1
SMILES CCCCC[C@@H](CC(=O)CCCCC[C@H](CC(=O)CCCCC[C@@H](CC(=O)CCCCC[C@H](C[C@H](C)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiBotryosphaeriaceaePhyllosticta maydis Ref.
zoom in