Chemical Compound

MFCD00145059

CAS Registry Number 159899-65-7
MFCD00145059 chemical structure
Primary Record

MFCD00145059

In stock
5,194 g
Purity
98.1 %
CAS
159899-65-7

Compound Identifiers & Properties

CAS
159899-65-7
PubChem CID
176450603
SMILES
CC[C@H](C)[C@@H](C(=N[C@@H](CC1=CC=C(C=C1)O)C(=N[C@@H](CCC(=N)O)C(=N[C@@H](CC2=CC=CC=C2)C(=N[C@@H]([C@@H](C)O)C(=N[C@@H](CC(=O)O)C(=N[C@@H](CCCCN)C(=N[C@@H](CC(=O)O)C(=N[C@@H](CCCCN)C(=N[C@@H](CC(=O)O)C(=N[C@@H](CC(=N)O)C(=N[C@@H](C(C)C)C(=N[C@@H](C)C(=O)N3CCC[C@H]3C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CO)C(=N[C@@H](CCCCN)C(=N[C@@H]([C@@H](C)CC)C(=N[C@@H](CO)C(=O)N4CCC[C@H]4C(=N[C@@H](CCC(=N)O)C(=NCC(=N[C@@H](CC5=CC=C(C=C5)O)C(=N)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)N=C([C@H](CCC(=N)O)N=C([C@H](CC6=CN=CN6)N=C([C@H](C)N=C([C@H](CC(C)C)N=C([C@H](CCCCN)N=C([C@H](CCC(=N)O)N=C([C@H](C(C)C)N=C([C@H]([C@@H](C)O)N)O)O)O)O)O)O)O)O
Canonical SMILES
CC[C@H](C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CO)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCCCN)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCCCN)N=C(O)[C@H](CC(=O)O)N=C(O)[C@@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCCCN)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@@H](N=C(O)[C@@H](N)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(C)C)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCC(=N)O)C(O)=NCC(O)=N[C@@H](Cc1ccc(O)cc1)C(=N)O

Names & Synonyms

  • MFCD00145059
  • C159H252N46O48
  • (3S)-3-[[(2S)-6-amino-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxy-butanoyl]amino]-3-methyl-butanoyl]amino]-5-oxo-pentanoyl]amino]hexanoyl]amino]-4-methyl-pentanoyl]amino]propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-5-oxo-pentanoyl]amino]-3-methyl-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxo-pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-hydroxy-butanoyl]amino]-3-carboxy-propanoyl]amino]hexanoyl]amino]-4-[[(1S)-5-amino-1-[[(1S)-2-[[(1S)-3-amino-1-[[(1S)-1-[[(1S)-2-[(2S)-2-[[(1S)-1-[[(1S)-2-[[(1S)-5-amino-1-[[(1S,2S)-1-[[(1S)-2-[(2S)-2-[[(1S)-4-amino-1-[[2-[[(1S)-2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]carbamoyl]pyrrolidin-1-yl]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]-2-methyl-but
  • 159899-65-7