Unii-uht9dnr5Z8
Basic information
- CAS
1220410-27-4- Standard SMILES
CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O- InChIKey
ZETRYLZQZNKUJD-QJUJJPHASA-N- Molecular formula
- C67H97N19O25S
- Average molar mass
- 1,600.7 g/mol
- Monoisotopic mass
- 1,599.66237083
Names & identifiers
- Preferred name
- Unii-uht9dnr5Z8
- IUPAC
- (4S)-5-[[(2S)-5-amino-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-[[(1S)-1-carboxyethyl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]acetyl]amino]propanoyl]amino]-4-carboxybutanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoic acid
Names & synonyms
UNII-UHT9DNR5Z8UHT9DNR5Z8Wilms tumor protein (77-91)Ser-Trp-Gly-Gly-Ala-Glu-Pro-His-Glu-Glu-Gln-Cys-Leu-Ser-Ala1220410-27-4L-Alanine, L-seryl-L-tryptophylglycylglycyl-L-alanyl-L-alpha-glutamyl-L-prolyl-L-histidyl-L-alpha-glutamyl-L-alpha-glutamyl-L-glutaminyl-L-cysteinyl-L-leucyl-L-seryl-L-Seryl-L-tryptophylglycylglycyl-L-alanyl-L-alpha-glutamyl-L-prolyl-L-histidyl-L-alpha-glutamyl-L-alpha-glutamyl-L-glutaminyl-L-cysteinyl-L-leucyl-L-seryl-L-alanine
Database identifiers
- CAS
1220410-27-4- PubChem CID
- 164512901
Properties
Computed structural properties
- XLogP
- -9.1
- Topological polar surface area
- 703 Ų
- Hydrogen bond donors
- 24
- Hydrogen bond acceptors
- 28
- Rotatable bonds
- 49
- Heavy atoms
- 112
- Formal charge
- 0
- Complexity
- 3,380
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Related reactions
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Compound notes
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