input word = C00021461

Metabolite InformationStructural formula
Name Melleolide C
Formula C24H32O8
Mw 448.209718
CAS RN 101901-56-8
C_ID C00021461 ,
InChIKey XXMVVKDVYBWXPQ-UNPWGTIKNA-N
InChICode InChI=1S/C24H32O8/c1-12-6-14(31-5)7-15(26)17(12)20(28)32-16-9-22(4)18-19(27)21(2,3)11-23(18,29)8-13(10-25)24(16,22)30/h6-8,16,18-19,25-27,29-30H,9-11H2,1-5H3/t16-,18-,19-,22-,23?,24+/m1/s1
SMILES C1(=C[C@@]2([C@@H]([C@@]3([C@]1([C@@H](C3)OC(=O)c1c(cc(cc1O)OC)C)O)C)[C@H](C(C2)(C)C)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeArmillaria mellea Ref.
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