input word = C00017223

Metabolite InformationStructural formula
Name Nannochelin B
Formula C37H46N4O13
Mw 754.30613759
CAS RN 133705-27-8
C_ID C00017223 ,
InChIKey MSIKUOJWOBZEKW-UHFFFAOYNA-N
InChICode InChI=1S/C37H46N4O13/c1-54-35(48)29(17-9-11-23-41(53)33(45)21-19-27-14-6-3-7-15-27)39-31(43)25-37(51,36(49)50)24-30(42)38-28(34(46)47)16-8-10-22-40(52)32(44)20-18-26-12-4-2-5-13-26/h2-7,12-15,18-21,28-29,51-53H,8-11,16-17,22-25H2,1H3,(H,38,42)(H,39,43)(H,46,47)(H,49,50)/b20-18-,21-19+/t28-,29+,37+/m1/s1
SMILES COC(=O)[C@H](CCCCN(C(=O)/C=C/c1ccccc1)O)NC(=O)C[C@](O)(C(=O)O)CC(=O)N[C@H](CCCCN(O)C(=O)/C=C\c1ccccc1)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaPolyangiaceaeNannocystis exedens Na e485 Ref.
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