Details of MURACEIN-B
| IUPAC | (2S)-10-[[(2R)-1-[[(2S)-2-[2-[(2S,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoylamino]propanoyl]-[(1R)-1-carboxyethyl]amino]-1-oxopropan-2-yl]amino]-2,9-diamino-6-(1,2-diamino-2-oxoethyl)-5,10-dioxodecanoic acid |
| Canonical Smiles | CC(C(=O)N(C(C)C(=O)O)C(=O)C(C)NC(=O)C(CCC(C(C(=O)N)N)C(=O)CCC(C(=O)O)N)N)NC(=O)C(C)OC1C(C(OC(C1O)CO)O)NC(=O)C |
| Inchi | QHRDRNITQKNXNS-JGYLIOAXSA-N |
| PubChem ID | 5491014 |
| Smiles | CC(=O)NC1C(O)OC(CO)C(O)C1OC(C)C(=O)NC(C)C(=O)N(C(=O)C(C)NC(=O)C(N)CCC(C(=O)CCC(N)C(=O)O)C(N)C(N)=O)C(C)C(=O)O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28%3DO%29NC1C%28O%29OC%28CO%29C%28O%29C1OC%28C%29C%28%3DO%29NC%28C%29C%28%3DO%29N%28C%28%3DO%29C%28C%29NC%28%3DO%29C%28N%29CCC%28C%28%3DO%29CCC%28N%29C%28%3DO%29O%29C%28N%29C%28N%29%3DO%29C%28C%29C%28%3DO%29O/file?format=sdf&get3d=True -- CC%28%3DO%29NC1C%28O%29OC%28CO%29C%28O%29C1OC%28C%29C%28%3DO%29NC%28C%29C%28%3DO%29N%28C%28%3DO%29C%28C%29NC%28%3DO%29C%28N%29CCC%28C%28%3DO%29CCC%28N%29C%28%3DO%29O%29C%28N%29C%28N%29%3DO%29C%28C%29C%28%3DO%29O could not be loaded.
| Class | |
| Super Class | |
| Pathways |
