Chemical Compound

J1.657.039G

J1.657.039G chemical structure
Primary Record

J1.657.039G

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177479185
SMILES
C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CNC=N2)C(=O)N[C@@H](C)C(=O)NCC(=O)N)NC(=O)[C@H](CC3=NC4=C(C=CC5=C4N=CC=C5)C=C3)NC(=O)[C@H](CO)NC(=O)[C@H]6CCCN6C(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC7=CC=C(C=C7)O)NC(=O)C)O
Canonical SMILES
CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc2ccc3cccnc3c2n1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)NCC(N)=O)[C@@H](C)O)C(C)C)[C@@H](C)O

Names & Synonyms

  • J1.657.039G
  • (4S)-4-{[(1S)-1-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-1-{[(1S)-1-{[(1S)-4-carbamimidamido-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-[(carbamoylmethyl)carbamoyl]ethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-3-methylbutyl]carbamoyl}butyl]carbamoyl}-3-methylbutyl]carbamoyl}-3-methylbutyl]carbamoyl}pentyl]carbamoyl}ethyl]carbamoyl}-3-methylbutyl]carbamoyl}-4-[(2S)-2-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-{[(2R)-1-[(2S)-2-[(2S,3R)-2-[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]-3-methylbutanoyl]pyrrolidin-2-yl]formamido}-3-hydroxypropanamido]-3-(1,10-phenanthrolin-2-yl)propanamido]-3-hydroxybutanamido]-3-phenylpropanamido]-3-hydroxypropanamido]pentanamido]-3-hydroxypropanamido]-3-carboxypropanamido]butanoic acid
  • Ac-L-Tyr-L-Thr-L-Val-D-Pro-L-Ser-3-(1,10-Phenanthroline-2-yl)-L-Ala-L-Thr-L-Phe-L-Ser-L-Arg-L-Ser-L-Asp-L-Glu-L-Leu-L-Ala-L-Lys-L-Leu-L-Leu-L-Arg-L-Leu-L-His-L-Ala-Gly-NH2