Chemical Compound

MFCD00165623

CAS Registry Number 123583-37-9
MFCD00165623 chemical structure
Primary Record

MFCD00165623

In stock
6,297 g
Purity
98.6 %
CAS
123583-37-9

Compound Identifiers & Properties

CAS
123583-37-9
PubChem CID
176450631
SMILES
C[C@H]([C@@H](C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CCC(=N)O)C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CC1=CC=C(C=C1)O)C(=N)O)O)O)O)O)N=C([C@H](C(C)C)N=C([C@H](CC(C)C)N=C([C@H](CC(=N)O)N=C([C@H](CC(C)C)N=C([C@H](CC2=CC=C(C=C2)O)N=C([C@H](CC3=CN=CN3)N=C([C@H](CCCNC(=N)N)N=C([C@H](CC(C)C)N=C([C@H](CO)N=C([C@H](C)N=C([C@H](CC4=CC=C(C=C4)O)N=C([C@H](CC5=CC=C(C=C5)O)N=C([C@H](CCCNC(=N)N)N=C([C@H](CO)N=C([C@H](CC(C)C)N=C([C@H](CCC(=O)O)N=C([C@H](CCC(=O)O)N=C([C@@H]6CCCN6C(=O)[C@H](CO)N=C([C@H](C)N=C([C@H](CC(=O)O)N=C([C@H](CCC(=O)O)N=C(CN=C([C@@H]7CCCN7C(=O)[C@H](C)N=C([C@H](CCC(=O)O)N=C([C@@H]8CCCN8C(=O)[C@H](CCCCN)N=C([C@H](C)N)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O
Canonical SMILES
CC(C)C[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CO)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](C)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)CN=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)N=C(O)[C@H](C)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CC(=N)O)C(O)=N[C@@H](CC(C)C)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=N)O)[C@@H](C)O)C(C)C

Names & Synonyms

  • MFCD00165623
  • C176H272N52O54
  • (4S)-5-[[(1S)-2-[[(1S)-2-[[(1S)-2-[(2S)-2-[[(1S)-1-[[(1S)-1-[[(1S)-1-[[(1S)-2-[[(1S)-1-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[(1S)-1-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[(1S)-3-amino-1-[[(1S)-1-[[(1S)-1-[[(1S,2R)-1-[[(1S)-1-[[(1S)-4-amino-1-[[(1S)-1-[[(1S)-2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-4-oxo-butyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-2-hydroxy-propyl]carbamoyl]-2-methyl-propyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-oxo-propyl]carbamoyl]-3-methyl-butyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-1-(1H-imidazol-4-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-3-methyl-butyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamoyl]-4-guanidino-butyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]
  • 123583-37-9