input word = C00048779

Metabolite InformationStructural formula
Name Miuraenamide E
Formula C33H40BrN3O7
Mw 669.20496355
CAS RN 1051915-36-6
C_ID C00048779 ,
InChIKey PFISZTVHMXNMTO-VDKZBZLGNA-N
InChICode InChI=1S/C33H40BrN3O7/c1-20-10-8-9-13-28(39)35-22(3)32(42)37(4)26(19-23-16-17-27(38)25(34)18-23)31(41)36-29(33(43)44-21(2)15-14-20)30(40)24-11-6-5-7-12-24/h5-7,10-12,16-18,21-22,26,29,38H,8-9,13-15,19H2,1-4H3,(H,35,39)(H,36,41)/b20-10+/t21-,22-,26-,29-/m0/s1
SMILES N1(C(=O)[C@@H](NC(=O)CCC/C=C(/CC[C@@H](OC(=O)[C@@H](NC(=O)[C@@H]1Cc1cc(c(cc1)O)Br)C(=O)c1ccccc1)C)\C)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Asp
Organism
Kingdom Family Species Reference
--Paralimyxa miuraensis Ref.
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