input word = C00044551

Metabolite InformationStructural formula
Name Asperpyrone B
Formula C32H26O11
Mw 586.14751167
CAS RN 491868-99-6
C_ID C00044551 ,
InChIKey VRAXHZQGYCOOCL-UHFFFAOYSA-N
InChICode InChI=1S/C32H26O11/c1-13-7-17(33)27-29(36)25(16-10-15(37-2)11-21(39-4)24(16)32(27)42-13)28-20(38-3)9-14-8-18(34)26-19(35)12-22(40-5)43-31(26)23(14)30(28)41-6/h7-12,34,36H,1-6H3
SMILES c1(=O)c2c(O)c(c3c(OC)cc4c(c3OC)c3c(c(c4)O)c(=O)cc(o3)OC)c3cc(cc(c3c2oc(c1)C)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus niger JV33-48 Ref.
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OrganismAspergillus niger JV33-48
ReferenceAkiyama,J.Nat.Prod.,66,(2003),136