input word = C00045213

Metabolite InformationStructural formula
Name Aeruginosin EI 461
(+)-Aeruginosin EI 461
Formula C24H35N3O6
Mw 461.25258587
CAS RN 449205-29-2
C_ID C00045213 ,
InChIKey FEBDAAYWFMTVBF-SOHPVECBNA-N
InChICode InChI=1S/C24H35N3O6/c1-13(2)9-18(26-23(32)21(30)10-14-3-6-16(28)7-4-14)24(33)27-19-12-17(29)8-5-15(19)11-20(27)22(25)31/h3-4,6-7,13,15,17-21,28-30H,5,8-12H2,1-2H3,(H2,25,31)(H,26,32)/t15-,17-,18-,19-,20+,21+/m1/s1
SMILES C1[C@H](C[C@@H]2[C@H](C1)C[C@H](N2C(=O)[C@H](NC(=O)[C@@H](O)Cc1ccc(cc1)O)CC(C)C)C(=O)N)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Pro L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
--Microcystis aeruginosa Ref.
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