CAS Number207386-83-2
SynonymsN-Benzoylglycyl-L-histidyl-L-leucine hydrate (1:1); N-Benzoylglycyl-L-histidyl-L-leucine hydrate; L-Leucine, N-benzoylglycyl-L-histidyl-, hydrate (1:1); N-Hippuryl-L-histidyl-L-leucine hydrate; N-Benzoyl-Gly-His-Leu hydrate; N-Hippuryl-His-Leu hydrate; N-Benzoyl-Gly-His-Leu; Bz-Gly-His-Ile-OH; MFCD00149318; EINECS 250-597-9
Molecular FormulaC21H29N5O6
Molecular Weight429.47 (anhydrous basis)
Melting Point108-110ºC (dec.)
Appearancewhite to off-white
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 207386-83-2 |
| Catalog No. | 2A-1183652 |
| Chinese Name | 马尿酰-组氨酰-亮氨酸 水合物 |
| Synonyms | N-Benzoylglycyl-L-histidyl-L-leucine hydrate (1:1); N-Benzoylglycyl-L-histidyl-L-leucine hydrate; L-Leucine, N-benzoylglycyl-L-histidyl-, hydrate (1:1); N-Hippuryl-L-histidyl-L-leucine hydrate; N-Benzoyl-Gly-His-Leu hydrate; N-Hippuryl-His-Leu hydrate; N-Benzoyl-Gly-His-Leu; Bz-Gly-His-Ile-OH; MFCD00149318; EINECS 250-597-9 |
| Molecular Formula | C21H29N5O6 |
| Molecular Weight | 429.47 (anhydrous basis) |
| Melting Point | 108-110ºC (dec.) |
| Appearance | white to off-white |
| Water Solubility | acetic acid: ~50mg/mL |
| Storage Condition | −20°C |
| Application | N-Benzoyl-Gly-His-Leu Hydrate is a leucine derivative, a polypeptide. N-Benzoyl-Gly-His-Leu Hydrate acts as an angiotensin-converting enzyme (ACE) substrate. |
| PubChem ID | 24888481 |
| SMILES | CC(C)CC(NC(=O)C(Cc1cnc[nH]1)NC(=O)CNC(=O)c1ccccc1)C(=O)O.O |
| InChI | InChI=1S/C21H27N5O5.H2O/c1-13(2)8-17(21(30)31)26-20(29)16(9-15-10-22-12-24-15)25-18(27)11-23-19(28)14-6-4-3-5-7-14;/h3-7,10,12-13,16-17H,8-9,11H2,1-2H3,(H,22,24)(H,23,28)(H,25,27)(H,26,29)(H,30,31);1H2/t16-,17-;/m0./s1 |
| InChI Key | NWOJMNXIJBZMPK-QJHJCNPRSA-N |
| Hazard Symbols | transportation |
| Bioactivity | N-Benzoyl-Gly-His-Leu hydrate is a leucine derivative, a polypeptide. N-Benzoyl-Gly-His-Leu hydrate exerts function with angiotensin converting enzyme (ACE) substrate. Related Catalog Signaling Pathways >> Others >> Others Chemical & Physical Properties Melting Point 108-110ºC (dec.) Molecular Formula C21H29N5O6 Molecular Weight 447.485 Exact Mass 447.211792 PSA 162.51000 LogP 1.59090 Appearance of Characters white to off-white InChIKey NWOJMNXIJBZMPK-QJHJCNPRSA-N SMILES CC(C)CC(NC(=O)C(Cc1cnc[nH]1)NC(=O)CNC(=O)c1ccccc1)C(=O)O.O Storage condition −20°C Water Solubility acetic acid: ~50mg/mL |
| Use of | N-Benzoyl-Gly-His-Leu hydrate is a leucine derivative, a polypeptide. N-Benzoyl-Gly-His-Leu hydrate exerts function with angiotensin converting enzyme (ACE) substrate. Properties Name (2S)-2-[[(2S)-2-[(2-benzamidoacetyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid,hydrate Synonym More Synonyms Biological Activity Description N-Benzoyl-Gly-His-Leu hydrate is a leucine derivative, a polypeptide. N-Benzoyl-Gly-His-Leu hydrate exerts function with angiotensin converting enzyme (ACE) substrate. Related Catalog Signaling Pathways >> Others >> Others Chemical & Physical Properties Molecular Formula C21H29N5O6 Exact Mass 447.211792 PSA 162.51000 LogP 1.59090 Appearance of Characters white to off-white InChIKey NWOJMNXIJBZMPK-QJHJCNPRSA-N |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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