Account Lacripep
- Catalog No. :
- ACOOZL584
- CAS No. :
- 2243095-21-6
- Molecular Formula :
- C106H167N27O29
- Molecular Weight :
- 2283.66
IUPAC Name:(4S,7S,13S,16S)-13-(2-amino-2-oxoethyl)-4-(((2S,5S,8S,11S,14S,17S,20S,23S,26S,29S)-1-amino-23-(3-amino-3-oxopropyl)-8,11,20-tris(4-aminobutyl)-5-benzyl-2-(hydroxymethyl)-14,17-diisobutyl-26-methyl-1,4,7,10,13,16,19,22,25,28-decaoxo-30-phenyl-3,6,9,12,15,18,21,24,27-nonaazatriacontan-29-yl)carbamoyl)-16-((2S,5S,8S,11S)-8-(3-amino-3-oxopropyl)-11-(4-aminobutyl)-5-benzyl-2-((S)-sec-butyl)-4,7,10,13-tetraoxo-3,6,9,12-tetraazatetradecanamido)-7-(hydroxymethyl)-6,9,12,15-tetraoxo-5,8,11,14-tetraazanonadecanedioic acid
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Product Information
| Product Name | Lacripep |
|---|---|
| IUPAC Name | (4S,7S,13S,16S)-13-(2-amino-2-oxoethyl)-4-(((2S,5S,8S,11S,14S,17S,20S,23S,26S,29S)-1-amino-23-(3-amino-3-oxopropyl)-8,11,20-tris(4-aminobutyl)-5-benzyl-2-(hydroxymethyl)-14,17-diisobutyl-26-methyl-1,4,7,10,13,16,19,22,25,28-decaoxo-30-phenyl-3,6,9,12,15,18,21,24,27-nonaazatriacontan-29-yl)carbamoyl)-16-((2S,5S,8S,11S)-8-(3-amino-3-oxopropyl)-11-(4-aminobutyl)-5-benzyl-2-((S)-sec-butyl)-4,7,10,13-tetraoxo-3,6,9,12-tetraazatetradecanamido)-7-(hydroxymethyl)-6,9,12,15-tetraoxo-5,8,11,14-tetraazanonadecanedioic acid |
| Molecular Formula | C106H167N27O29 |
| Molecular Weight | 2283.66 |
| SMILES | O=C(O)CC[C@@H](C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](C)C(N[C@@H](CCC(N)=O)C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCCN)C(N[C@@H](CCCCN)C(N[C@@H](CC2=CC=CC=C2)C(N[C@@H](CO)C(N)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)NC([C@H](CO)NC(CNC([C@H](CC(N)=O)NC([C@@H](NC([C@H]([C@@H](C)CC)NC([C@H](CC3=CC=CC=C3)NC([C@H](CCC(N)=O)NC([C@H](CCCCN)NC(C)=O)=O)=O)=O)=O)CCC(O)=O)=O)=O)=O)=O |
| InChI Key | LQIGMWPYUDATJX-GKKSKUFBSA-N |
| Synonym | Lacripep |
| CAS No. | 2243095-21-6 |
Synthetic Route by SureRoute
2. ACOOZL584 Molecular Building Block Synthetic Route
(2S,5S,8S,11S,14S,17S,20S,23S)-23-amino-14-(2-amino-2-oxoethyl)-5-(4-aminobutyl)-11-benzyl-17,20-di((S)-sec-butyl)-8-(2-carboxyethyl)-24-hydroxy-2-isobutyl-4,7,10,13,16,19,22-heptaoxo-3,6,9,12,15,18,21-heptaazatetracosanoic acid
Aurein 1.1
(2S,5S,8S,11S,14S,17S,20S,23S)-23-amino-14-(2-amino-2-oxoethyl)-5-(4-aminobutyl)-11-benzyl-17,20-di((S)-sec-butyl)-8-(2-carboxyethyl)-24-hydroxy-2-isobutyl-4,7,10,13,16,19,22-heptaoxo-3,6,9,12,15,18,21-heptaazatetracosanoic acid--2,2,2-trifluoroacetic acid (1/1)