input word = C00014942

Metabolite InformationStructural formula
Name SM 216289
SPF 3059-1
Xanthofulvin
Formula C28H18O14
Mw 578.06965529
CAS RN 15466-15-8
C_ID C00014942 ,
InChIKey VZJACTNXARYXEM-NHDPSOOVSA-N
InChICode InChI=1S/C28H18O14/c1-7-9(21(32)11-6-41-14-4-12(30)24(35)19(27(37)38)17(14)23(11)34)3-10-22(33)18-15(42-26(10)16(7)8(2)29)5-13(31)25(36)20(18)28(39)40/h3-5,30-32,35-36H,6H2,1-2H3,(H,37,38)(H,39,40)/b21-11-
SMILES CC(=O)c1c(C)c(/C(O)=C2COc3cc(O)c(O)c(C(=O)O)c3C2=O)cc2c(=O)c3c(C(=O)O)c(O)c(O)cc3oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium sp. SPF-3059 Ref.
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