input word = C00052889

Metabolite InformationStructural formula
Name Daldinin A
Formula C15H18O5
Mw 278.11542369
CAS RN 1033349-49-3
C_ID C00052889
InChIKey ZJXXJTICUDDUSG-SUZMYJTESA-N
InChICode InChI=1S/C15H18O5/c1-4-9-7-5-6-8-11(16)13(15(2,3)18)20-12(8)10(7)14(17)19-9/h5-6,9,11,13,16,18H,4H2,1-3H3/t9-,11+,13-/m1/s1
SMILES CC[C@H]1OC(=O)c2c1ccc1c2O[C@@H](C(C)(C)O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiXylariaceaeDaldinia concentrica Ref.
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OrganismDaldinia concentrica
ReferenceGao, J-M. et al., Chem. Rev., 113, (2013), 4755-4811.