input word = C00045018

Metabolite InformationStructural formula
Name Pochonin B
Formula C18H19ClO7
Mw 382.08193067
CAS RN 544712-81-4
C_ID C00045018 ,
InChIKey BDHDUOMSMIFYEX-PTFPWSEBNA-N
InChICode InChI=1S/C18H19ClO7/c1-8-4-14-15(26-14)6-10(21)3-2-9(20)5-11-16(18(24)25-8)12(22)7-13(23)17(11)19/h2-3,7-8,10,14-15,21-23H,4-6H2,1H3/b3-2+/t8-,10-,14-,15-/m1/s1
SMILES C[C@@H]1C[C@H]2O[C@@H]2C[C@H](O)/C=C/C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiClavicipitaceaePochonia chlamydosporia var.catenulata strain P0297 Ref.
zoom in