Bombesin (6-14), D-Phe(6)-Leu(13)-psi(CH2NH)-Phe(14)-
Basic information
- CAS
123769-98-2- Standard SMILES
CC(C)C[C@@H](CN[C@@H](Cc1ccccc1)C(N)=O)N[C@@H](Cc1cnc[nH]1)C(=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)Cc1ccccc1)C(C)C- InChIKey
SDORTRZDJZBYPG-SAQNLQCKSA-N- Molecular formula
- C56H76N14O9
- Average molar mass
- 1,089.3 g/mol
- Monoisotopic mass
- 1,088.59197006
Overview
bombesin receptor antagonists on pancreatic secretion in rats
Names & identifiers
- Preferred name
- Bombesin (6-14), D-Phe(6)-Leu(13)-psi(CH2NH)-Phe(14)-
- IUPAC
- (2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-2-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-methylpentan-2-yl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2R)-2-amino-3-phenylpropanoyl]amino]pentanediamide
- English name
- bombesin (6-14), D-Phe(6)-Leu(13)-psi(CH2NH)-Phe(14)-
- Molecular formula
- C56H76N14O9
- Molecular weight
- 1089.29104
Names & synonyms
123769-98-2Bombesin (6-14), D-phe(6)-leu(13)-psi(CH2NH)-phe(14)-RC-3100DTXSID701540846-Phe-13-leu-psi(CH2NH)-14-phe-bombesin (6-14)Bombesin (6-14), D-phenylalanyl(6)-leucyl(13)-psi(methyleneamino)-phenylalanyl(14)-L-Histidinamide, D-phenylalanyl-L-glutaminyl-L-tryptophyl-L-alanyl-L-valylglycyl-N-(1-(((2-amino-2-oxo-1-(phenylmethyl)ethyl)amino)methyl)-3-methylbutyl)-, (S-(R*,R*))-RefChem:120923DTXCID7076575RC 3100D-Phenylalanyl-L-glutaminyl-L-tryptophyl-L-alanyl-L-valyl-N-[(2S)-2-{[(2S)-1-{[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino}-4-methylpentan-2-yl]amino}-3-(1H-imidazol-5-yl)propanoyl]glycinamide
Database identifiers
- CAS
123769-98-2- PubChem CID
- 5487260
- DTXSID
DTXSID70154084
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 372 Ų
- Hydrogen bond donors
- 13
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 32
- Heavy atoms
- 79
- Formal charge
- 0
- Complexity
- 2,020
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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