input word = C00053498

Metabolite InformationStructural formula
Name Monarubrin
Formula C20H26O4
Mw 330.18310932
CAS RN 1206782-87-7
C_ID C00053498
InChIKey MIHSWRHCWJWHMB-VMPITWQZSA-N
InChICode InChI=1S/C20H26O4/c1-4-6-7-9-16(21)12-15-10-14-11-17(8-5-2)24-13-18(14)19(22)20(15,3)23/h5,8,10-11,13,15,23H,4,6-7,9,12H2,1-3H3/b8-5+
SMILES C/C=C/C1=CC2=CC(CC(=O)CCCCC)C(C)(O)C(=O)C2=CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiElaphomycetaceaeMonascus ruber ATCC 96218 Ref.
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OrganismMonascus ruber ATCC 96218
ReferenceGao, J-M. et al., Chem. Rev., 113, (2013), 4755-4811.