Chemical Compound

J1.104.010A

J1.104.010A chemical structure
Primary Record

J1.104.010A

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177406866
SMILES
COC1=CC=C(C=C1)C[C@H](C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCCNC(=O)C4=CC5=C(C=C4)C(=O)OC56C7=C(C=C(C=C7)O)OC8=C6C=CC(=C8)O)C(=O)N)NC(=O)CCC9=CC=C(C=C9)O
Canonical SMILES
COc1ccc(C[C@@H](NC(=O)CCc2ccc(O)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCNC(=O)c2ccc3c(c2)C2(OC3=O)c3ccc(O)cc3Oc3cc(O)ccc32)C(N)=O)cc1

Names & Synonyms

  • J1.104.010A
  • (2S)-N-[(1S)-1-{[(2S)-5-carbamimidamido-1-[(2S)-2-{[(1S)-1-carbamoyl-5-({3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-6-yl}formamido)pentyl]carbamoyl}pyrrolidin-1-yl]-1-oxopentan-2-yl]carbamoyl}-2-carbamoylethyl]-2-[(2S)-2-[(2R)-2-[3-(4-hydroxyphenyl)propanamido]-3-(4-methoxyphenyl)propanamido]-3-phenylpropanamido]pentanediamide
  • N-[3-(4-Hydroxyphenyl)propionyl]-O-methyl-D-Tyr-L-Phe-L-Gln-L-Asn-L-Arg-L-Pro-N6-[(3-oxo-3 ,6 -dihydroxyspiro[isobenzofuran-1(3H),9 -[9H]xanthene]-6-yl)carbonyl]-L-Lys-NH2