Chemical Compound

J598.789J

J598.789J chemical structure
Primary Record

J598.789J

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
16138211
SMILES
CCCC[C@@H](C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H]2CCCN2C(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](C)NC(=O)[C@H](CCCCNC(=S)NC6=CC7=C(C=C6)C8(C9=C(C=C(C=C9)O)OC1=C8C=CC(=C1)O)OC7=O)NC(=O)C1=CC=CC=C1
Canonical SMILES
CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCCCNC(=S)Nc1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21)NC(=O)c1ccccc1)C(N)=O

Names & Synonyms

  • J598.789J
  • (2S)-N-[(1S)-1-{[(1R)-1-{[(2S)-1-[(2R)-2-[(2S)-2-{[(1S)-1-carbamoylpentyl]carbamoyl}pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl]-6-[({3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-5-yl}carbamothioyl)amino]-2-(phenylformamido)hexanamide
  • Bz-N6-[[[3 ,6 -Dihydroxy-3-oxospiro[isobenzofuran-1(3H),9 -[9H]xanthen]-5-yl]amino](thiocarbonyl)]-L-Lys-L-Ala-D-Trp-L-Phe-D-Pro-L-Pro-L-Nle-NH2