Account 22-((1H-indol-3-yl)methyl)-31-(2-amino-2-oxoethyl)-19,34-bis(4-aminobutyl)-37-(2-(2-aminopropanamido)acetamido)-13,25,28-tribenzyl-10,16-bis(1-hydroxyethyl)-7-(hydroxymethyl)-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-4-carboxylic acid
- Catalog No. :
- ACXBIK027
- CAS No. :
- 51110-01-1
- Molecular Formula :
- C76H104N18O19S2
- Molecular Weight :
- 1637.91
IUPAC Name:22-((1H-indol-3-yl)methyl)-31-(2-amino-2-oxoethyl)-19,34-bis(4-aminobutyl)-37-(2-(2-aminopropanamido)acetamido)-13,25,28-tribenzyl-10,16-bis(1-hydroxyethyl)-7-(hydroxymethyl)-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-4-carboxylic acid
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Product Information
| Product Name | 22-((1H-indol-3-yl)methyl)-31-(2-amino-2-oxoethyl)-19,34-bis(4-aminobutyl)-37-(2-(2-aminopropanamido)acetamido)-13,25,28-tribenzyl-10,16-bis(1-hydroxyethyl)-7-(hydroxymethyl)-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-4-carboxylic acid |
|---|---|
| IUPAC Name | 22-((1H-indol-3-yl)methyl)-31-(2-amino-2-oxoethyl)-19,34-bis(4-aminobutyl)-37-(2-(2-aminopropanamido)acetamido)-13,25,28-tribenzyl-10,16-bis(1-hydroxyethyl)-7-(hydroxymethyl)-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-4-carboxylic acid |
| MDL No. | MFCD00076762 |
| Molecular Formula | C76H104N18O19S2 |
| Molecular Weight | 1637.91 |
| SMILES | CC(N)C(=O)NCC(=O)NC1CSSCC(C(=O)O)NC(=O)C(CO)NC(=O)C(C(C)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C(C)O)NC(=O)C(CCCCN)NC(=O)C(CC2=CNC3=CC=CC=C23)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(N)=O)NC(=O)C(CCCCN)NC1=O |
| InChI Key | NHXLMOGPVYXJNR-UHFFFAOYSA-N |
| Synonym | AGCKNFFWKTFTSC (modifications: Disulfide bridge between 3 - 14) | AKOS015896026 | BCA11001 | SCHEMBL3046327 | SOMATOSTATIN | Stilamin | AGCKNFFWKTFTSC | Somatostain Acetate | FT-0630640 | L000577 | Panhibin | Somatostatin 14 | NHXLMOGPVYXJNR-UHFFFAOYSA-N |
| CAS No. | 51110-01-1 |
| PubChem CID | 16129681 |
Synthetic Route by SureRoute
2. ACXBIK027 Molecular Building Block Synthetic Route
Somatostatin-14 (3-14)
(4R,7S,10S,13S,16S,19S,22S,25S,28S,31S,34S,37R)-22-((1H-indol-3-yl)methyl)-31-(2-amino-2-oxoethyl)-19,34-bis(4-aminobutyl)-37-(2-((S)-2-aminopropanamido)acetamido)-13,25,28-tribenzyl-10,16-bis((R)-1-hydroxyethyl)-7-(hydroxymethyl)-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-4-carboxylic acid--acetic acid (1/1)
(4R,7S,10S,13S,16S,19S,22S,25S,28S,31S,34S,37R)-22-((1H-indol-3-yl)methyl)-31-(2-amino-2-oxoethyl)-37-(2-((S)-2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)propanamido)acetamido)-19,34-bis(4-aminobutyl)-13,25,28-tribenzyl-10,16-bis((R)-1-hydroxyethyl)-7-(hydroxymethyl)-6,9,12,15,18,21,24,27,30,33,36-undecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35-undecaazacyclooctatriacontane-4-carboxylic acid