L-Prolinamide, L-tyrosyl-D-arginylglycyl-4-nitro-L-phenylalanyl-
(2S)-1-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
Also Known As: H-Tyr-D-Arg-Gly-Phe(4-NO2)-Pro-NH2|L-Tyr-D-Arg-Gly-4-Nitro-L-Phe-L-Pro-NH2|L-Prolinamide, L-tyrosyl-D-arginylglycyl-4-nitro-L-phenylalanyl-|L-Tyrosyl-N~5~-(diaminomethylidene)-D-ornithylglycyl-4-nitro-L-phenylalanyl-L-prolinamide|(2S)-1-[(2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-5-carbamimidamidopentanamido]acetamido}-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide
| Molecular Formula | C31H42N10O8 |
|---|---|
| Molecular Weight | 682.3187 g/mol |
| LogP | -1.9714 |
| Topological Polar Surface Area | 304.49 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 17 |
| Exact Mass | 682.3187 |
| Monoisotopic Mass | 682.3187 |
| Heavy Atoms | 49 |
| Complexity | 1529.7593 |
Chemical Identifiers
| CAS Number | 88331-13-9 |
|---|---|
| SMILES | C1C[C@H](N(C1)C(=O)[C@H](CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CNC(=O)[C@@H](CCCN=C(N)N)NC(=O)[C@H](CC3=CC=C(C=C3)O)N)C(=O)N |
Product Overview
L-Prolinamide, L-tyrosyl-D-arginylglycyl-4-nitro-L-phenylalanyl- (CAS 88331-13-9), with molecular formula C31H42N10O8 and molecular weight 682.3187 g/mol. IUPAC: (2S)-1-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-3-(4-nitrophenyl)propanoyl]pyrrolidine-2-carboxamide.