Chemical Compound
(4S)-4-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-methyl-butanoyl]amino]-4-oxo-butanoyl]amino]-5-[[(1S)-2-[[(1S)-4-amino-1-[[2-[(2S)-2-[[(1S)-1-[[(1S)-2-[(2S)-2-[[(1S)-2-[[2-[[2-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[(1S)-2-[[(1S)-1-[(2S)-2-[[(1S)-1-[[(1S)-3-amino-1-carbamoyl-3-oxo-propyl]carbamoyl]-4-guanidino-butyl]carbamoyl]pyrrolidine-1-carbonyl]-4-guanidino-butyl]amino]-1-benzyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-1-benzyl-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]pyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
CAS Registry Number
117505-80-3
Primary record
(4S)-4-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-methyl-butanoyl]amino]-4-oxo-butanoyl]amino]-5-[[(1S)-2-[[(1S)-4-amino-1-[[2-[(2S)-2-[[(1S)-1-[[(1S)-2-[(2S)-2-[[(1S)-2-[[2-[[2-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[(1S)-2-[[(1S)-1-[(2S)-2-[[(1S)-1-[[(1S)-3-amino-1-carbamoyl-3-oxo-propyl]carbamoyl]-4-guanidino-butyl]carbamoyl]pyrrolidine-1-carbonyl]-4-guanidino-butyl]amino]-1-benzyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-1-benzyl-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]pyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
- 库存
- 9,752 克
- 纯度
- 98.5 %
- CAS
- 117505-80-3
化合物标识与属性
- CAS
- 117505-80-3
- PubChem CID
- 175647726
- SMILES
- C[C@@H](C(=O)N1CCC[C@H]1C(=N[C@@H](CO)C(=NCC(=NCC(=N[C@@H](CC2=CC=CC=C2)C(=N[C@@H](CC3=CC=CC=C3)C(=N[C@@H](CC(C)C)C(=N[C@@H](CC4=CC=CC=C4)C(=N[C@@H](CCCNC(=N)N)C(=O)N5CCC[C@H]5C(=N[C@@H](CCCNC(=N)N)C(=N[C@@H](CC(=N)O)C(=N)O)O)O)O)O)O)O)O)O)O)O)N=C([C@H](C(C)C)N=C([C@@H]6CCCN6C(=O)CN=C([C@H](CCC(=N)O)N=C([C@H](CC7=CC=C(C=C7)O)N=C([C@H](CCC(=O)O)N=C([C@H](CC(=N)O)N=C([C@H](C(C)C)N=C([C@H](CCCCN)N=C([C@H](CC8=CC=C(C=C8)O)N)O)O)O)O)O)O)O)O)O
- Canonical SMILES
- CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@H](CO)N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@@H]1CCCN1C(=O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(=N)O)N=C(O)[C@@H](N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(=N)O)C(=N)O
名称与同义词
- MFCD00076672
- C124H180N34O31
- 117505-80-3
- (4S)-4-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-methyl-butanoyl]amino]-4-oxo-butanoyl]amino]-5-[[(1S)-2-[[(1S)-4-amino-1-[[2-[(2S)-2-[[(1S)-1-[[(1S)-2-[(2S)-2-[[(1S)-2-[[2-[[2-[[(1S)-2-[[(1S)-2-[[(1S)-1-[[(1S)-2-[[(1S)-1-[(2S)-2-[[(1S)-1-[[(1S)-3-amino-1-carbamoyl-3-oxo-propyl]carbamoyl]-4-guanidino-butyl]carbamoyl]pyrrolidine-1-carbonyl]-4-guanidino-butyl]amino]-1-benzyl-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-1-benzyl-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]pyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]-4-oxo-butyl]amino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
- L-Tyrosyl-L-Lysyl-L-Valyl-L-Asparaginyl-L-Alpha-Glutamyl-L-Tyrosyl-L-Glutaminylglycyl-L-Prolyl-L-Valyl-L-Alanyl-L-Prolyl-L-Serylglycylglycyl-L-Phenylalanyl-L-Phenylalanyl-L-Leucyl-L-Phenylalanyl-L-Arginyl-L-Prolyl-L-Arginyl-L-Aspartamide