Basic information
- CAS
77275-51-5- Standard SMILES
CSCC[C@H](NC(=O)[C@H](Cc1ccc([O-])cc1)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)OS(=O)(=O)[O-])C(=O)N[C@@H](Cc1ccccc1)C(N)=O.[Na+].[Na+]- InChIKey
RAGVOFDQBXZYNT-BGBFCPIGSA-N- Molecular formula
- C47H57N9Na2O14S3
- Average molar mass
- 1,114.2 g/mol
- Monoisotopic mass
- 1,113.29824961
Overview
stimulates contraction of the in situ guinea pig gall bladder
Names & identifiers
- Preferred name
- Acetylcholecystokinin C-terminal heptapeptide
- IUPAC
- disodium;[(3S)-3-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-acetamido-3-(4-oxidophenyl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoyl] sulfate
- English name
- AC-TYR(SO3H)-MET-GLY-TRP-MET-ASP-PHE-NH2
- Molecular formula
- C47H59N9O14S3
- Molecular weight
- 1070.22
Names & synonyms
Acetylcholecystokinin C-terminal heptapeptideAccck(27-33)77275-51-5L-Phenylalaninamide, N-acetyl-O-sulfo-L-tyrosyl-L-methionylglycyl-L-tryptophyl-L-methionyl-L-alpha-aspartyl-, disodium saltRefChem:109122disodium;[(3S)-3-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-acetamido-3-(4-oxidophenyl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoyl] sulfateAcetyl-CCK-7 (sulfated)Ac-CCK-8 (2-8) (sulfated)AC-TYR(SO3H)-MET-GLY-TRP-MET-ASP-PHE-NH2Acetyl-Cholecystokinin Octapeptide (2-8)ACETYL-TYR(SO3H)-MET-GLY-TRP-MET-ASP-PHE-NH2AC-CHOLECYSTOKININ OCTAPEPTIDE (2-8) (SULFATED)
Show more names
cholecystokinin (ac-tyr-so3H27)-*fragment 27-33 AACETYL-CHOLECYSTOKININ OCTAPEPTIDE (2-8) (SULFATED)CHOLECYSTOKININ (AC-TYR-SO3H27)-FRAGMENT 27-33 AMI
Properties
Computed structural properties
- Topological polar surface area
- 428 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 29
- Heavy atoms
- 75
- Formal charge
- 0
- Complexity
- 1,990
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Suppliers11 total
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
太原百利恒康生物技术有限公司19135651983 · [email protected]
LEON (NANJING) BIOTECHNOLOGY CO., LTD.15051830413 · [email protected]
杭州专肽生物技术有限公司17342063383 · [email protected]
南京莱昂生物科技有限公司025-84523390 -127; 17705183659 · [email protected]
南京肽业生物科技有限公司025-58361106-805 15951641583 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
吉尔生化(上海)有限公司21-61263452 13641803416 · [email protected]
重庆卡兰医药有限公司[email protected]
DONBOO AMINO ACID COMPANY13063595538 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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