input word = C00041486

Metabolite InformationStructural formula
Name Decaspirone C
(+)-Decaspirone C
Formula C20H18O5
Mw 338.11542369
CAS RN 920516-08-1
C_ID C00041486 ,
InChIKey GNGBJYHHQABICI-JYFMATSGNA-N
InChICode InChI=1S/C20H18O5/c21-12-7-8-14(23)19-18(12)13(22)9-10-20(19)24-15-5-1-3-11-4-2-6-16(25-20)17(11)15/h1-6,9-10,12,14,18-19,21,23H,7-8H2/t12-,14+,18-,19+/m0/s1
SMILES c1ccc2c3c1OC1(Oc3ccc2)[C@H]2[C@H](C(=O)C=C1)[C@H](CC[C@H]2O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMassariaceaeDecaisnella thyridioides Ref.
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