Chemical Compound

J412.725K

J412.725K chemical structure
Primary Record

J412.725K

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177535587
SMILES
C[C@@H]([C@@H]1C(=O)NC(C(SSC([C@H](C(=O)NCC(=O)N1)NC(=O)[C@H](CC2=CC=C(C=C2)O)N)(C)C)(C)C)C(=O)O)C3=CC=C(C=C3)[N+](=O)[O-]
Canonical SMILES
C[C@H](c1ccc([N+](=O)[O-])cc1)[C@H]1NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)C(C(=O)O)NC1=O

Names & Synonyms

  • J412.725K
  • L-Tyr-D-Pen(1)-Gly-[(betaR)-beta-Methyl-4-nitro-D-Phe-]D-Pen(1)-OH
  • (4S,7R,13S)-13-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3,3,14,14-tetramethyl-7-[(1R)-1-(4-nitrophenyl)ethyl]-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid