Chemical Compound

penicillin deriv. 44

penicillin deriv. 44 chemical structure
Primary Record

penicillin deriv. 44

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
454977
SMILES
CC1([C@@H](N[C@H](S1)[C@@H](C(=O)NCC(=O)OC(C)(C)C)NC(=O)C2=CC=CC=C2C3=CC=CC=C3)C(=O)NCCNC(=O)[C@H]4C(S[C@@H](N4)[C@@H](C(=O)NCC(=O)OC(C)(C)C)NC(=O)C5=CC=CC=C5C6=CC=CC=C6)(C)C)C
Canonical SMILES
CC(C)(C)OC(=O)CNC(=O)[C@@H](NC(=O)c1ccccc1-c1ccccc1)[C@@H]1N[C@@H](C(=O)NCCNC(=O)[C@@H]2N[C@@H]([C@H](NC(=O)c3ccccc3-c3ccccc3)C(=O)NCC(=O)OC(C)(C)C)SC2(C)C)C(C)(C)S1

Names & Synonyms

  • penicillin deriv. 44
  • AC1L9RZU
  • Penicillin Et(NH)2 dimer
  • BDBM631
  • CHEMBL274534
  • Penicillin Et(NH)2 Sym dimer
  • CID454977
  • [2R-[2.alpha.(R*),4.-beta.-]]-4,4'-[1,2-Ethanediylbis[aminocarbonyl]]bis[5,5-dimethyl-.alpha.-[[[(1,1'-biphenyl)-2-yl]carbonyl]amino]-N-[(1,1-dimethylethoxy)carbonylmethyl]-2-thiazolidineacetamide]
  • tert-butyl 2-[(2R)-2-[(2R,4S)-4-[(2-{[(2R,4S)-2-[(R)-{[2-(tert-butoxy)-2-oxoethyl]carbamoyl}[(2-phenylphenyl)formamido]methyl]-5,5-dimethyl-1,3-thiazolidin-4-yl]formamido}ethyl)carbamoyl]-5,5-dimethyl-1,3-thiazolidin-2-yl]-2-[(2-phenylphenyl)formamido]acetamido]acetate
  • tert-butyl 2-[[(2R)-2-[(2R,4S)-4-[2-[[(2R,4S)-2-[(1R)-2-[(2-tert-butoxy-2-oxo-ethyl)amino]-2-oxo-1-[(2-phenylbenzoyl)amino]ethyl]-5,5-dimethyl-thiazolidine-4-carbonyl]amino]ethylcarbamoyl]-5,5-dimethyl-thiazolidin-2-yl]-2-[(2-phenylbenzoyl)amino]acetyl]amino]acetate
  • tert-butyl 2-[[(2R)-2-[(2R,4S)-4-[2-[[(2R,4S)-5,5-dimethyl-2-[(1R)-2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-2-oxo-1-[(2-phenylbenzoyl)amino]ethyl]-1,3-thiazolidine-4-carbonyl]amino]ethylcarbamoyl]-5,5-dimethyl-1,3-thiazolidin-2-yl]-2-[(2-phenylbenzoyl)amino]acetyl]amino]acetate