Chemical Compound

J1.451.506B

J1.451.506B chemical structure
Primary Record

J1.451.506B

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177529639
SMILES
CCC1=C(C2=CC3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=N5)C=C1N2)C)CC)C)CCC(=O)NCCCCC(C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NCC(=O)NCC(=O)NC(CSSC6=CC=CC=N6)C(=O)O)NC(=O)C(C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(C)N)C(=C3C)CCC(=O)O)C
Canonical SMILES
CCC1=C(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(=O)NCCCCC(NC(=O)C(C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(C)N)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NCC(=O)NCC(=O)NC(CSSc1ccccn1)C(=O)O)C(CCC(=O)O)=C4C)c(C)c3CC

Names & Synonyms

  • J1.451.506B
  • 4-{[1-({1-[(5-amino-1-{[5-amino-1-({1-[(1-{[1-({1-[(1-{[5-amino-1-({5-amino-1-[(1-{[1-({[({[1-carboxy-2-(pyridin-2-yldisulfanyl)ethyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)ethyl]carbamoyl}-3-methylbutyl)carbamoyl]pentyl}carbamoyl)pentyl]carbamoyl}-5-{3-[20-(2-carboxyethyl)-9,14-diethyl-5,10,15,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-4-yl]propanamido}pentyl)carbamoyl]ethyl}carbamoyl)-3-carboxypropyl]carbamoyl}-3-carboxypropyl)carbamoyl]-3-methylbutyl}carbamoyl)pentyl]carbamoyl}pentyl)carbamoyl]-3-methylbutyl}carbamoyl)ethyl]carbamoyl}-4-{2-[2-(2-aminopropanamido)-4-methylpentanamido]-4-carboxybutanamido}butanoic acid
  • L-Ala-L-Leu-L-Glu-L-Glu-L-Ala-L-Leu-L-Lys-L-Lys-L-Leu-L-Glu-L-Glu-L-Ala-N6-[3-[3,8,13,17-Tetramethyl-7,12-diethyl-18-(3-oxo-3-hydroxypropyl)-21H,23H-porphyrin-2-yl]propionyl]-L-Lys-L-Lys-L-Lys-L-Leu-L-Ala-Gly-Gly-S-(2-pyridylthio)-L-Cys-OH