input word = C00027062

Metabolite InformationStructural formula
Name Aeruginosin 298-A
(+)-Aeruginosin 298-A
Formula C30H48N6O7
Mw 604.35844793
CAS RN 156312-05-9
C_ID C00027062 ,
InChIKey OIHPUVZVWDKLOQ-HVQKARGKNA-N
InChICode InChI=1S/C30H48N6O7/c1-3-17(2)26(35-28(42)25(40)13-18-6-9-21(38)10-7-18)29(43)36-23-15-22(39)11-8-19(23)14-24(36)27(41)34-20(16-37)5-4-12-33-30(31)32/h6-7,9-10,17,19-20,22-26,37-40H,3-5,8,11-16H2,1-2H3,(H,34,41)(H,35,42)(H4,31,32,33)/t17-,19+,20+,22-,23+,24+,25-,26-/m1/s1
SMILES C1[C@H](C[C@H]2[C@@H](C1)C[C@H](N2C(=O)[C@@H]([C@H](C)CC)NC(=O)[C@@H](Cc1ccc(cc1)O)O)C(=O)N[C@@H](CCCNC(=N)N)CO)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
--Microcystis aeruginosa NIES-298 Ref.
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