Account (5S,8S,11S,14S,17S,20S,23S,26S)-17-(2-carboxyethyl)-23-(carboxymethyl)-5-(3-((diaminomethylene)amino)propyl)-14-(4-hydroxybenzyl)-8,11,20-trimethyl-4,7,10,13,16,19,22,25-octaoxo-26-((6S,9S,12S,15S)-1,1,6-triamino-15-((S)-sec-butyl)-9-(3-((diaminomethylene)amino)propyl)-12-isobutyl-7,10,13-trioxo-2,8,11,14-tetraazahexadec-1-en-16-amido)-3,6,9,12,15,18,21,24-octaazanonacosanedioic acid--acetic acid (1/1)
- Catalog No. :
- ACPNGP229
- CAS No. :
- 2986315-28-8
- Molecular Formula :
- C66H110N22O23
- Molecular Weight :
- 1579.74
IUPAC Name:(5S,8S,11S,14S,17S,20S,23S,26S)-17-(2-carboxyethyl)-23-(carboxymethyl)-5-(3-((diaminomethylene)amino)propyl)-14-(4-hydroxybenzyl)-8,11,20-trimethyl-4,7,10,13,16,19,22,25-octaoxo-26-((6S,9S,12S,15S)-1,1,6-triamino-15-((S)-sec-butyl)-9-(3-((diaminomethylene)amino)propyl)-12-isobutyl-7,10,13-trioxo-2,8,11,14-tetraazahexadec-1-en-16-amido)-3,6,9,12,15,18,21,24-octaazanonacosanedioic acid--acetic acid (1/1)
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Product Information
| Product Name | (5S,8S,11S,14S,17S,20S,23S,26S)-17-(2-carboxyethyl)-23-(carboxymethyl)-5-(3-((diaminomethylene)amino)propyl)-14-(4-hydroxybenzyl)-8,11,20-trimethyl-4,7,10,13,16,19,22,25-octaoxo-26-((6S,9S,12S,15S)-1,1,6-triamino-15-((S)-sec-butyl)-9-(3-((diaminomethylene)amino)propyl)-12-isobutyl-7,10,13-trioxo-2,8,11,14-tetraazahexadec-1-en-16-amido)-3,6,9,12,15,18,21,24-octaazanonacosanedioic acid--acetic acid (1/1) |
|---|---|
| IUPAC Name | (5S,8S,11S,14S,17S,20S,23S,26S)-17-(2-carboxyethyl)-23-(carboxymethyl)-5-(3-((diaminomethylene)amino)propyl)-14-(4-hydroxybenzyl)-8,11,20-trimethyl-4,7,10,13,16,19,22,25-octaoxo-26-((6S,9S,12S,15S)-1,1,6-triamino-15-((S)-sec-butyl)-9-(3-((diaminomethylene)amino)propyl)-12-isobutyl-7,10,13-trioxo-2,8,11,14-tetraazahexadec-1-en-16-amido)-3,6,9,12,15,18,21,24-octaazanonacosanedioic acid--acetic acid (1/1) |
| Molecular Formula | C66H110N22O23 |
| Molecular Weight | 1579.74 |
| SMILES | CC(=O)O.CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)O |
| InChI Key | AUPCFXKHMLBEKC-YQYPCEDLSA-N |
| Synonym | RR src acetate,RRsrc acetate;RR-src acetate |
| CAS No. | 2986315-28-8 |
Synthetic Route by SureRoute
2. ACPNGP229 Molecular Building Block Synthetic Route
((S)-2-((S)-2-amino-3-carboxypropanamido)-5-((diaminomethylene)amino)pentanoyl)-L-valyl-L-tyrosyl-L-isoleucine
(3S,6S,9S,12S,15S,18S,24S)-3-amino-18-benzyl-24-carbamoyl-6-(3-((diaminomethylene)amino)propyl)-12-(4-hydroxybenzyl)-15-(hydroxymethyl)-9-isobutyl-26-methyl-4,7,10,13,16,19,22-heptaoxo-5,8,11,14,17,20,23-heptaazaheptacosanoic acid
(2S,5S,17S,20S,26S,29S,35S,41S,44S)-44-((S)-2-aminopropanamido)-26-benzyl-17,35-bis(2-carboxyethyl)-29-(carboxymethyl)-2-(3-((diaminomethylene)amino)propyl)-41-(hydroxymethyl)-23-isobutyl-5-isopropyl-20-methyl-4,7,10,13,16,19,22,25,28,31,34,37,40,43-tetradecaoxo-3,6,9,12,15,18,21,24,27,30,33,36,39,42-tetradecaazahexatetracontanedioic acid