input word = C00017614

Metabolite InformationStructural formula
Name Rubiginone B1
Formula C20H18O4
Mw 322.12050906
CAS RN 130364-39-5
C_ID C00017614 ,
InChIKey GCPUVEMWOWMALU-JEVNKCSWNA-N
InChICode InChI=1S/C20H18O4/c1-10-8-11-6-7-13-18(16(11)14(21)9-10)20(23)12-4-3-5-15(24-2)17(12)19(13)22/h3-7,10,14,21H,8-9H2,1-2H3/t10-,14-/m0/s1
SMILES COc1cccc2c1C(=O)c1ccc3c(c1C2=O)[C@@H](O)C[C@@H](C)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces griseorubiginosus No.Q144-2 Ref.
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