input word = C00026639

Metabolite InformationStructural formula
Name Spirotryprostatin A
(-)-Spirotryprostatin A
Formula C22H25N3O4
Mw 395.18450631
CAS RN 182234-25-9
C_ID C00026639 ,
InChIKey MQJKGSIAJNXSCM-IMYOSLMENA-N
InChICode InChI=1S/C22H25N3O4/c1-12(2)9-18-22(14-7-6-13(29-3)10-15(14)23-21(22)28)11-17-19(26)24-8-4-5-16(24)20(27)25(17)18/h6-7,9-10,16-18H,4-5,8,11H2,1-3H3,(H,23,28)/t16-,17-,18-,22-/m0/s1
SMILES COc1ccc2c(c1)NC(=O)[C@@]21C[C@H]2C(=O)N3CCC[C@H]3C(=O)N2[C@H]1C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus Ref.
FungiTrichocomaceaeAspergillus sydowi PFW1-13 Ref.
FungiTrichocomaceaeTalaromyces sp. LGT-2 Ref.
--Isaria tenuipes BCC12625 Ref.
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