Chemical Compound

LXPHPKVWHQLBBA-UHFFFAOYSA-N

CAS Registry Number 121695-87-2
Back to search Request a Quote
LXPHPKVWHQLBBA-UHFFFAOYSA-N chemical structure
Primary Record

LXPHPKVWHQLBBA-UHFFFAOYSA-N

In stock
1,241 g
Purity
98.8 %
CAS
121695-87-2

Compound Identifiers & Properties

CAS
121695-87-2
PubChem CID
56947135
SMILES
CCC(C)C(C(=NC(CC1=CNC2=CC=CC=C21)C(=O)O)O)N=C(C(C(C)C)N=C(C(CC(=O)O)N=C(C(CCC(=N)O)N=C(C(CC3=CN=CN3)N=C(C4CSSCC(C(=NC(C(=NC5CSSCC(C(=NC(C(=NC(C(=NC(C(=N4)O)CC6=CC=CC=C6)O)CC(=N)O)O)CC(C)C)O)N=C(C(N=C(C(N=C(C(N=C(C(N=C(C(N=C(C(N=C(C(N=C5O)CC(=N)O)O)CC(=O)O)O)CCSC)O)C(C)O)O)CC(=O)O)O)CCC(=O)O)O)CCC(=O)O)O)O)C(C)O)O)N)O)O)O)O)O
Canonical SMILES
CCC(C)C(N=C(O)C(N=C(O)C(CC(=O)O)N=C(O)C(CCC(=N)O)N=C(O)C(Cc1cnc[nH]1)N=C(O)C1CSSCC(N)C(O)=NC(C(C)O)C(O)=NC2CSSCC(N=C(O)C(CCC(=O)O)N=C(O)C(CCC(=O)O)N=C(O)C(CC(=O)O)N=C(O)C(C(C)O)N=C(O)C(CCSC)N=C(O)C(CC(=O)O)N=C(O)C(CC(=N)O)N=C2O)C(O)=NC(CC(C)C)C(O)=NC(CC(=N)O)C(O)=NC(Cc2ccccc2)C(O)=N1)C(C)C)C(O)=NC(Cc1c[nH]c2ccccc12)C(=O)O

Names & Synonyms

  • LXPHPKVWHQLBBA-UHFFFAOYSA-N
  • C103H147N27O37S5
  • 121695-87-2
  • 3-[[5-amino-2-[[2-[[31-amino-22,42-bis(2-amino-2-oxo-ethyl)-39-benzyl-4,7-bis(2-carboxyethyl)-10,19-bis(carboxymethyl)-13,28-bis(1-hydroxyethyl)-45-isobutyl-16-(2-methylsulfanylethyl)-3,6,9,12,15,18,21,24,27,30,38,41,44,47-tetradecaoxo-33,34,49,50-tetrathia-2,5,8,11,14,17,20,23,26,29,37,40,43,46-tetradecazabicyclo[23.22.4]henpentacontane-36-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-5-oxo-pentanoyl]amino]-4-[[1-[[1-[[1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl]-2-methyl-butyl]carbamoyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid