input word = C00052457

Metabolite InformationStructural formula
Name (-)-Mitorubrinic acid
Formula C21H16O9
Mw 412.07943211
CAS RN 34695-99-3
C_ID C00052457
InChIKey ZJIWQCFXEQSFGR-YEFOHOTDSA-N
InChICode InChI=1S/C21H16O9/c1-10-5-12(22)8-15(23)18(10)20(28)30-21(2)16(24)7-11-6-13(3-4-17(25)26)29-9-14(11)19(21)27/h3-9,22-23H,1-2H3,(H,25,26)/b4-3+/t21-/m1/s1
SMILES Cc1cc(O)cc(O)c1C(=O)O[C@]1(C)C(=O)C=C2C=C(/C=C/C(=O)O)OC=C2C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPleosporaceaeCochliobolus lunatus Ref.
FungiTrichocomaceaePenicillium funiculosum CCM F-8080 Ref.
FungiTrichocomaceaePenicillium funiculosum IFO 6345 Ref.
FungiTrichocomaceaePenicillium rubrum Ref.
FungiTrichocomaceaePenicillium vermiculatum IV/5 Ref.
FungiTrichocomaceaeTalaromyces austrocalifornicus Ref.
FungiTrichocomaceaeTalaromyces convolutus Ref.
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OrganismPenicillium rubrum
ReferenceGao, J-M. et al., Chem. Rev., 113, (2013), 4755-4811.