input word = C00056483

Metabolite InformationStructural formula
Name 13-Hydroxy-5'-O-methylmelledonal
Formula C24H30O9
Mw 462.18898256
CAS RN 112471-06-4
C_ID C00056483
InChIKey GEZFFZYSQRTAPC-HYYSFWKASA-N
InChICode InChI=1S/C24H30O9/c1-12-5-14(32-4)6-15(27)17(12)20(29)33-16-8-22(3)18-19(28)21(2,11-26)10-23(18,30)7-13(9-25)24(16,22)31/h5-7,9,16,18-19,26-28,30-31H,8,10-11H2,1-4H3/t16-,18-,19-,21+,22-,23+,24+/m0/s1
SMILES O=CC1=C[C@]2(O)[C@]([C@H](O)[C@@](C)(CO)C2)([H])[C@@]3(C)[C@]1(O)[C@@H](OC(C4=C(C)C=C(OC)C=C4O)=O)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeArmillaria mellea Ref.
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OrganismArmillaria mellea
ReferenceDonnelly, D.M.X. et al., Phytochemistry, 1987, 26, 3075