input word = C00045032

Metabolite InformationStructural formula
Name Pseurotin A
(-)-Pseurotin A
Formula C22H25NO8
Mw 431.15801678
CAS RN 58523-30-1
C_ID C00045032 ,
InChIKey SLYDIPAXCVVRNY-ZJDPBXQVNA-N
InChICode InChI=1S/C22H25NO8/c1-4-5-11-14(24)15(25)16-12(2)17(26)21(31-16)19(28)22(30-3,23-20(21)29)18(27)13-9-7-6-8-10-13/h5-11,14-15,19,24-25,28H,4H2,1-3H3,(H,23,29)/b11-5-/t14-,15-,19+,21+,22+/m0/s1
SMILES C(=C\[C@H](O)[C@@H](C1=C(C)C(=O)[C@]2(O1)C(=O)N[C@]([C@@H]2O)(C(=O)c1ccccc1)OC)O)\CC
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-Phe
Organism
Kingdom Family Species Reference
FungiClavicipitaceaePochonia chlamydosporia var.catenulata strain P0297 Ref.
FungiTrichocomaceaeAspergillus fumigatus Ref.
--Isaria tenuipes BCC12625 Ref.
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