input word = C00011305

Metabolite InformationStructural formula
Name 9,10-Dihydroexserohilone
Formula C20H24N2O6S2
Mw 452.10757797
CAS RN 99572-23-3
C_ID C00011305 ,
InChIKey QOXQVMHGUNMPOZ-LPSMJYSZNA-N
InChICode InChI=1S/C20H24N2O6S2/c1-29-19-7-9-11(23)3-5-13(25)15(9)21(19)18(28)20(30-2)8-10-12(24)4-6-14(26)16(10)22(20)17(19)27/h3,5,9-10,13-16,25-26H,4,6-8H2,1-2H3/t9-,10-,13+,14+,15+,16+,19-,20-/m0/s1
SMILES CS[C@]12C[C@H]3C(=O)C=C[C@@H](O)[C@@H]3N1C(=O)[C@@]1(SC)C[C@H]3C(=O)CC[C@@H](O)[C@@H]3N1C2=O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
PlantaePoaceaeDactyloctenium aegyptium Ref.
--Exserohilum holmii Ref.
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