Chemical Compound

MFCD00133543

CAS Registry Number 85490-53-5
MFCD00133543 chemical structure
Primary Record

MFCD00133543

In stock
4,515 g
Purity
98.6 %
CAS
85490-53-5

Compound Identifiers & Properties

CAS
85490-53-5
PubChem CID
176446211
SMILES
CC[C@H](C)[C@@H](C(=N[C@@H](CC1=CC=CC=C1)C(=N[C@@H]([C@@H](C)O)C(=N[C@@H](CC2=CN=CN2)C(=N[C@@H](CO)C(=N[C@@H](CCC(=O)O)C(=N[C@@H](CC(C)C)C(=N[C@@H](CCC(=N)O)C(=N[C@@H](CCCCN)C(=N[C@@H]([C@@H](C)CC)C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CCC(=O)O)C(=N[C@@H](CCCCN)C(=N[C@@H](CCC(=O)O)C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CC(=N)O)C(=N[C@@H](CCCCN)C(=NCC(=N[C@@H](CCC(=N)O)C(=O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)N=C([C@@H]3CCCN3C(=O)[C@H](C(C)C)N=C([C@H](CC4=CC=CC=C4)N)O)O
Canonical SMILES
CC[C@H](C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N=C(O)[C@@H](N)Cc1ccccc1)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(=N)O)C(O)=N[C@@H](CCCCN)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(=O)O

Names & Synonyms

  • MFCD00133543
  • C120H194N36O34
  • (2S)-5-amino-2-[[2-[[(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-phenyl-propanoyl]amino]-3-hydroxy-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-4-carboxy-butanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxo-pentanoyl]amino]hexanoyl]amino]-3-methyl-pentanoyl]amino]-5-guanidino-pentanoyl]amino]-4-carboxy-butanoyl]amino]hexanoyl]amino]-4-carboxy-butanoyl]amino]-5-guanidino-pentanoyl]amino]-4-oxo-butanoyl]amino]hexanoyl]amino]acetyl]amino]-5-oxo-pentanoic acid
  • 85490-53-5