input word = C00048582

Metabolite InformationStructural formula
Name 1-Deoxytetrahydrobostrycin
Formula C16H20O7
Mw 324.12090299
CAS RN 1072119-08-4
C_ID C00048582 ,
InChIKey LNMXRONIHUOFQM-BYQPUBTANA-N
InChICode InChI=1S/C16H20O7/c1-16(22)5-7-6(3-10(16)18)13(19)11-8(17)4-9(23-2)15(21)12(11)14(7)20/h4,6-7,10,14,17-18,20-22H,3,5H2,1-2H3/t6-,7-,10+,14+,16-/m0/s1
SMILES COc1cc(O)c2c(c1O)[C@H](O)[C@H]1C[C@](C)(O)[C@H](O)C[C@@H]1C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus sp. Ref.
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OrganismAspergillus sp.
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165