input word = C00053135

Metabolite InformationStructural formula
Name Deflectin 1a
Formula C21H24O5
Mw 356.16237388
CAS RN 79495-61-7
C_ID C00053135
InChIKey YNVKQPJBOAUYIJ-OAQYLSRUSA-N
InChICode InChI=1S/C21H24O5/c1-4-5-6-7-8-9-16(22)18-19-15-12-25-13(2)10-14(15)11-17(23)21(19,3)26-20(18)24/h10-12H,4-9H2,1-3H3/t21-/m1/s1
SMILES CCCCCCCC(=O)C1=C2C3=COC(C)=CC3=CC(=O)[C@@]2(C)OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Annulohypoxylon deflectus Ref.
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OrganismAnnulohypoxylon deflectus
ReferenceOsmanova, N. et al. Phytochem. Rev., 9, (2010), 315-342.