input word = C00015070

Metabolite InformationStructural formula
Name Asterobactin
Formula C34H55N7O13
Mw 769.3857849
CAS RN 482372-30-5
C_ID C00015070 ,
InChIKey ICFNGWYSCWYFGU-XWFNIOTCNA-N
InChICode InChI=1S/C34H55N7O13/c1-3-4-5-6-7-8-17-28(22(2)29(45)37-24(30(46)39-50)14-12-19-41(52)34(35)36)54-33(49)25(15-11-18-40(51)21-42)38-31(47)27(44)20-53-32(48)23-13-9-10-16-26(23)43/h9-10,13,16,21-22,24-25,27-28,43-44,50-52H,3-8,11-12,14-15,17-20H2,1-2H3,(H3,35,36)(H,37,45)(H,38,47)(H,39,46)/t22-,24+,25+,27+,28+/m1/s1
SMILES N(CCC[C@H](NC(=O)[C@H](COC(=O)c1ccccc1O)O)C(=O)O[C@@H](CCCCCCCC)[C@H](C(=O)N[C@@H](CCCN(C(=N)N)O)C(=O)NO)C)(O)C=O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
BacteriaNocardiaceaeNocardia asteroides IFM 0959 Ref.
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