input word = C00052482

Metabolite InformationStructural formula
Name (+)-Mitorubrinol
Formula C21H18O8
Mw 398.10016755
CAS RN 54984-83-7
C_ID C00052482
InChIKey NXJNWGPNUAVXHT-SHTLVRLNSA-N
InChICode InChI=1S/C21H18O8/c1-11-6-13(23)9-16(24)18(11)20(27)29-21(2)17(25)8-12-7-14(4-3-5-22)28-10-15(12)19(21)26/h3-4,6-10,22-24H,5H2,1-2H3/b4-3+/t21-/m0/s1
SMILES Cc1cc(O)cc(O)c1C(=O)O[C@@]1(C)C(=O)C=C2C=C(/C=C/CO)OC=C2C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeTalaromyces emodensis Ref.
FungiTrichocomaceaeTalaromyces wortmannii var. sublevisporus Ref.
FungiXylariaceaeHypoxylon fragiforme Ref.
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OrganismTalaromyces emodensis
ReferenceGao, J-M. et al., Chem. Rev., 113, (2013), 4755-4811.