Account Thioether-cyclized helix B peptide, CHBP
- Catalog No. :
- ACOBCY444
- CAS No. :
- 1453840-35-1
- Molecular Formula :
- C56H93N19O22S
- Molecular Weight :
- 1416.54
IUPAC Name:3,3'-((5S,8S,11S,14S,17S,20S,23S,26S,29S,35S,38R)-29-(2-amino-2-oxoethyl)-5,11-bis(3-amino-3-oxopropyl)-38-carbamoyl-20-(3-guanidinopropyl)-32,35-bis(hydroxymethyl)-14,26-diisobutyl-23-methyl-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxo-1-thia-4,7,10,13,16,19,22,25,28,31,34,37-dodecaazacyclononatriacontane-8,17-diyl)dipropionic acid
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Product Information
| Product Name | Thioether-cyclized helix B peptide, CHBP |
|---|---|
| IUPAC Name | 3,3'-((5S,8S,11S,14S,17S,20S,23S,26S,29S,35S,38R)-29-(2-amino-2-oxoethyl)-5,11-bis(3-amino-3-oxopropyl)-38-carbamoyl-20-(3-guanidinopropyl)-32,35-bis(hydroxymethyl)-14,26-diisobutyl-23-methyl-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxo-1-thia-4,7,10,13,16,19,22,25,28,31,34,37-dodecaazacyclononatriacontane-8,17-diyl)dipropionic acid |
| Molecular Formula | C56H93N19O22S |
| Molecular Weight | 1416.54 |
| SMILES | CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CSC[C@@H](C(N)=O)NC(=O)[C@H](CO)NC(=O)C(CO)NC(=O)[C@H](CC(N)=O)NC1=O |
| InChI Key | KSNPRNVCPCWSPM-SYPTZYETSA-N |
| Synonym | Thioether-cyclized helix B peptide, CHBP;L-Cysteinamide, N2-(2-mercaptoacetyl)-L-glutaminyl-L-α-glutamyl-L-glutaminyl-L-leucyl-L-α-glutamyl-L-arginyl-L-alanyl-L-leucyl-L-asparaginyl-L-seryl-L-seryl-, cyclic (1→12)-thioether |
| CAS No. | 1453840-35-1 |
Synthetic Route by SureRoute
2. ACOBCY444 Molecular Building Block Synthetic Route
L-asparaginyl-L-seryl-L-aspartyl-L-cysteinyl-L-isoleucyl-L-isoleucyl-L-seryl-L-arginyl-L-lysyl-L-isoleucyl-L-glutamyl-L-glutaminyl-L-lysyl-L-glutamic acid
L-asparaginyl-L-asparaginyl-L-leucyl-L-alanyl-L-seryl-L-seryl-L-seryl-L-seryl-L-serylglycyl-L-cysteinyl-L-cysteine
(6R,9R,12R,15R,18R,21R,24R,27R,30R,33S,36R,39S,42R,45R,48R,51R)-1,6-Diamino-51-(2-amino-2-oxoethyl)-36-(3-amino-3-oxopropyl)-48-(4-aminobutyl)-9,12,15,18,21,24,27,30,42,45-decakis(3-guanidinopropyl)-1-imino-33,39-bis(mercaptomethyl)-7,10,13,16,19,22,25,28,31,34,37,40,43,46,49-pentadecaoxo-2,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50-hexadecaazadopentacontan-52-oic acid