input word = C00018577

Metabolite InformationStructural formula
Name Muracein B
Formula C32H54N8O16
Mw 806.36577774
CAS RN 90965-61-0
C_ID C00018577 ,
InChIKey JJLNIKUTLBJNSR-CASKHVRINA-N
InChICode InChI=1S/C32H54N8O16/c1-13(27(48)37-15(3)31(52)53)36-30(51)19(8-6-7-18(33)26(34)47)39-23(45)10-9-20(32(54)55)40-28(49)14(2)35-29(50)16(4)56-25(24(46)22(44)12-42)21(11-41)38-17(5)43/h11,13-16,18-22,24-25,42,44,46H,6-10,12,33H2,1-5H3,(H2,34,47)(H,35,50)(H,36,51)(H,37,48)(H,38,43)(H,39,45)(H,40,49)(H,52,53)(H,54,55)/t13-,14-,15+,16+,18+,19-,20-,21+,22-,24-,25+/m1/s1
SMILES OC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](CCC[C@@H](C(=O)N)N)NC(=O)CC[C@H](C(=O)O)NC(=O)[C@@H](C)NC(=O)[C@H](C)O[C@H]([C@@H]([C@@H](CO)O)O)[C@H](C=O)NC(=O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
BacteriaNocardiaceaeNocardia orientalis SC 12842 Ref.
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