input word = C00048840

Metabolite InformationStructural formula
Name Purealidin T
(+)-Purealidin T
Formula C23H27Br4N3O6
Mw 756.86333722
CAS RN 1060771-18-7
C_ID C00048840 ,
InChIKey UERURZJARADPSH-UPMWDJCYNA-N
InChICode InChI=1S/C23H27Br4N3O6/c1-30(2,33)7-4-8-35-19-14(24)9-13(10-15(19)25)5-6-28-22(32)17-12-23(36-29-17)11-16(26)20(34-3)18(27)21(23)31/h9-11,21,31H,4-8,12H2,1-3H3,(H,28,32)/t21-,23+/m0/s1
SMILES COC1=C(Br)[C@H](O)[C@@]2(C=C1Br)CC(C(=O)NCCc1cc(Br)c(OCCC[N+](C)(C)[O-])c(Br)c1)=NO2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro
Organism
Kingdom Family Species Reference
--Pseudoceratina sp. Ref.
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