Primary Record
ent-Bacitracin A
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 177623448
- SMILES
- CC[C@@H](C)[C@@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@@H](C(=O)N[C@H](C(=O)N1)CCCN)CCCCN)C(=O)[C@@H]([C@H](C)CC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H]2CSC(=N2)[C@@H]([C@H](C)CC)N)CC(=O)N)CC(=O)O)CC3=CN=CN3)CC4=CC=CC=C4
- Canonical SMILES
- CC[C@@H](C)[C@@H](N)C1=N[C@@H](C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(=O)N2C(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](Cc3cnc[nH]3)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H]([C@H](C)CC)NC(=O)[C@H](CCCN)NC(=O)[C@H]2CCCCN)[C@H](C)CC)CS1
Names & Synonyms
- ent-Bacitracin A
- J2.017.782I
- (4S)-4-[(2R)-2-{[(4S)-2-[(1R,2R)-1-amino-2-methylbutyl]-4,5-dihydro-1,3-thiazol-4-yl]formamido}-4-methylpentanamido]-4-{[(2R,3R)-1-[(2R,5S,8R,11S,14R,17S,20R)-2-(4-aminobutyl)-5-(3-aminopropyl)-11-benzyl-8-[(2R)-butan-2-yl]-20-(carbamoylmethyl)-17-(carboxymethyl)-14-[(1H-imidazol-4-yl)methyl]-3,6,9,12,15,18,21-heptaoxo-1,4,7,10,13,16,19-heptaazacyclohenicosan-1-yl]-3-methyl-1-oxopentan-2-yl]carbamoyl}butanoic acid
- N2-[N-[[(4S)-2-[(1R,2R)-1-Amino-2-methylbutyl]-2-thiazoline-4beta-yl]carbonyl]-D-Leu-L-Glu-D-Ile-]cyclo(D-Lys-L-Orn-D-Ile-L-Phe-D-His-L-Asp-D-Asn-)