input word = C00046270

Metabolite InformationStructural formula
Name Panepophenanthrin
(+)-Panepophenanthrin
Formula C22H28O8
Mw 420.17841787
CAS RN 409064-57-9
C_ID C00046270 ,
InChIKey WQBRQZUREPTGLI-VCUIZWGWNA-N
InChICode InChI=1S/C22H28O8/c1-19(2,26)5-6-21-9-7-8-10(13(24)16-15(28-16)12(8)23)11(21)14(25)17-18(29-17)22(21,27)30-20(9,3)4/h5-7,9-11,13-18,24-27H,1-4H3/b6-5+/t9-,10-,11-,13-,14-,15-,16+,17+,18+,21+,22+/m1/s1
SMILES CC(C)(O)/C=C/[C@@]12[C@H]3[C@@H](O)[C@@H]4O[C@@H]4[C@]1(O)OC(C)(C)[C@H]2C=C1C(=O)[C@H]2O[C@H]2[C@H](O)[C@H]13
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPolyporaceaePanus rudis Fr.IFO8994 Ref.
zoom in