Account (2S,5S,8S,11S,14S)-8-(2-amino-2-oxoethyl)-14-((S)-2-((S)-2-((S)-2-((S)-2-aminopropanamido)propanamido)-3-(1H-imidazol-5-yl)propanamido)propanamido)-11-((S)-sec-butyl)-5-(2-carboxyethyl)-2-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaheptadecanedioic acid
- Catalog No. :
- ACZLMW698
- CAS No. :
- 276889-40-8
- Molecular Formula :
- C38H60N12O15
- Molecular Weight :
- 924.97
IUPAC Name:(2S,5S,8S,11S,14S)-8-(2-amino-2-oxoethyl)-14-((S)-2-((S)-2-((S)-2-((S)-2-aminopropanamido)propanamido)-3-(1H-imidazol-5-yl)propanamido)propanamido)-11-((S)-sec-butyl)-5-(2-carboxyethyl)-2-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaheptadecanedioic acid
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Product Information
| Product Name | (2S,5S,8S,11S,14S)-8-(2-amino-2-oxoethyl)-14-((S)-2-((S)-2-((S)-2-((S)-2-aminopropanamido)propanamido)-3-(1H-imidazol-5-yl)propanamido)propanamido)-11-((S)-sec-butyl)-5-(2-carboxyethyl)-2-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaheptadecanedioic acid |
|---|---|
| IUPAC Name | (2S,5S,8S,11S,14S)-8-(2-amino-2-oxoethyl)-14-((S)-2-((S)-2-((S)-2-((S)-2-aminopropanamido)propanamido)-3-(1H-imidazol-5-yl)propanamido)propanamido)-11-((S)-sec-butyl)-5-(2-carboxyethyl)-2-methyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaheptadecanedioic acid |
| Molecular Formula | C38H60N12O15 |
| Molecular Weight | 924.97 |
| SMILES | CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O |
| InChI Key | WDUIVGVJPMWQBK-DACHUPBLSA-N |
| Synonym | L-Alanine, L-alanyl-L-alanyl-L-histidyl-L-alanyl-L-α-glutamyl-L-isoleucyl-L-asparaginyl-L-α-glutamyl- (9CI) |
| CAS No. | 276889-40-8 |
Synthetic Route by SureRoute
2. ACZLMW698 Molecular Building Block Synthetic Route
(2S,8S,11S,14S,17S,20S)-14-(2-amino-2-oxoethyl)-20-((2S,5S,8S,11S,14S,17S,20S,23S,26S,29S,30S)-5,14-bis((1H-imidazol-4-yl)methyl)-29-amino-23-(3-amino-3-oxopropyl)-26-(hydroxymethyl)-17-isopropyl-2,8,11,20,30-pentamethyl-4,7,10,13,16,19,22,25,28-nonaoxo-3,6,9,12,15,18,21,24,27-nonaazadotriacontanamido)-17-((S)-sec-butyl)-11-(2-carboxyethyl)-2-(3-guanidinopropyl)-8-methyl-4,7,10,13,16,19-hexaoxo-3,6,9,12,15,18-hexaazatricosanedioic acid
VLHDDLLEA
H-Pro-His-Glu-OH