Account ((S)-2-((S)-2-((S)-2-(2-(2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)acetamido)acetamido)-3-phenylpropanamido)-4-methylpentanamido)-5-((diaminomethylene)amino)pentanoyl)-L-lysyl-L-tyrosyl-L-proline--acetic acid (1/1)
- Catalog No. :
- ACPKWX183
- CAS No. :
- 78658-39-6
- Molecular Formula :
- C56H81N13O14
- Molecular Weight :
- 1160.34
IUPAC Name:((S)-2-((S)-2-((S)-2-(2-(2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)acetamido)acetamido)-3-phenylpropanamido)-4-methylpentanamido)-5-((diaminomethylene)amino)pentanoyl)-L-lysyl-L-tyrosyl-L-proline--acetic acid (1/1)
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Product Information
| Product Name | ((S)-2-((S)-2-((S)-2-(2-(2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)acetamido)acetamido)-3-phenylpropanamido)-4-methylpentanamido)-5-((diaminomethylene)amino)pentanoyl)-L-lysyl-L-tyrosyl-L-proline--acetic acid (1/1) |
|---|---|
| IUPAC Name | ((S)-2-((S)-2-((S)-2-(2-(2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)acetamido)acetamido)-3-phenylpropanamido)-4-methylpentanamido)-5-((diaminomethylene)amino)pentanoyl)-L-lysyl-L-tyrosyl-L-proline--acetic acid (1/1) |
| Molecular Formula | C56H81N13O14 |
| Molecular Weight | 1160.34 |
| SMILES | CC(=O)O.CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)O |
| InChI Key | RRCNWDRSUKZIGO-CODYCENXSA-N |
| Synonym | beta-Neoendorphin acetate(77739-21-0 free base);betaNeoendorphin acetate(77739210 free base),beta Neoendorphin acetate(77739 21 0 free base);beta-Neoendorphin acetate |
| CAS No. | 78658-39-6 |
Synthetic Route by SureRoute
2. ACPKWX183 Molecular Building Block Synthetic Route
((S)-2-((S)-2-((S)-2-(2-(2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)acetamido)acetamido)-3-phenylpropanamido)-4-methylpentanamido)-5-((diaminomethylene)amino)pentanoyl)-L-lysyl-L-tyrosyl-L-proline
((S)-2-((S)-2-((S)-2-((S)-2-(2-((S)-2-((S)-1-(L-lysyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)acetamido)-6-aminohexanamido)-6-aminohexanamido)-5-((diaminomethylene)amino)pentanamido)-5-((diaminomethylene)amino)pentanoyl)-L-prolyl-L-valyl-L-lysyl-L-valyl-L-tyrosyl-L-proline--acetic acid (1/1)
((S)-2-((S)-2-((S)-2-((S)-2-(2-((S)-2-((S)-1-(L-lysyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)acetamido)-6-aminohexanamido)-6-aminohexanamido)-5-((diaminomethylene)amino)pentanamido)-5-((diaminomethylene)amino)pentanoyl)-L-prolyl-L-valyl-L-lysyl-L-valyl-L-tyrosyl-L-proline