input word = C00018698

Metabolite InformationStructural formula
Name Cochliobolin B
Zizanin B
Formula C25H38O4
Mw 402.2770097
CAS RN 5601-74-1
C_ID C00018698 ,
InChIKey SXRLPRKYTRWOES-DFEJPCJTNA-N
InChICode InChI=1S/C25H38O4/c1-16(2)7-6-8-17(3)25(29)12-11-23(4)13-19-22(20(27)14-24(19,5)28)18(15-26)9-10-21(23)25/h7,9,15,17,19,21-22,28-29H,6,8,10-14H2,1-5H3/b18-9-/t17-,19-,21+,22+,23+,24+,25-/m0/s1
SMILES CC(C)=CCC[C@H](C)[C@@]1(O)CC[C@]2(C)C[C@H]3[C@H](C(=O)C[C@@]3(C)O)/C(C=O)=CC[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPleosporaceaeCochliobolus miyabeanus Ref.
FungiPleosporaceaeHelminthosporium zizaniae Ref.
zoom in