Account Abecomotide
- Catalog No. :
- ACRVRY813
- CAS No. :
- 907596-50-3
- Molecular Formula :
- C45H79N13O16
- Molecular Weight :
- 1058.20
IUPAC Name:(2S,5S,8S,11S,14S)-14-((S)-4-amino-2-((S)-2-((2S,3R)-2-((S)-2,6-diaminohexanamido)-3-hydroxybutanamido)-3-methylbutanamido)-4-oxobutanamido)-5-(2-amino-2-oxoethyl)-8-(3-amino-3-oxopropyl)-2,11-diisobutyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaheptadecanedioic acid
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Product Information
| Product Name | Abecomotide |
|---|---|
| IUPAC Name | (2S,5S,8S,11S,14S)-14-((S)-4-amino-2-((S)-2-((2S,3R)-2-((S)-2,6-diaminohexanamido)-3-hydroxybutanamido)-3-methylbutanamido)-4-oxobutanamido)-5-(2-amino-2-oxoethyl)-8-(3-amino-3-oxopropyl)-2,11-diisobutyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazaheptadecanedioic acid |
| Molecular Formula | C45H79N13O16 |
| Molecular Weight | 1058.20 |
| SMILES | O=C(O)[C@H](CC(C)C)NC([C@H](CC(N)=O)NC([C@H](CCC(N)=O)NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CCCCN)=O)[C@H](O)C)=O)C(C)C)=O)CC(N)=O)=O)CCC(O)=O)=O)=O)=O)=O |
| InChI Key | ZWMQPLOHUFKNPF-RQEVSVBXSA-N |
| Synonym | Abecomotide;L-Leucine, L-lysyl-L-threonyl-L-valyl-L-asparaginyl-L-α-glutamyl-L-leucyl-L-glutaminyl-L-asparaginyl- |
| CAS No. | 907596-50-3 |
Synthetic Route by SureRoute
2. ACRVRY813 Molecular Building Block Synthetic Route
L-asparaginyl-L-valyl-L-lysyl-L-seryl-L-lysyl-L-isoleucylglycyl-L-seryl-L-threonyl-L-glutamyl-L-asparaginyl-L-leucyl-L-lysine
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L-lysyl-L-lysyl-L-lysyl-L-valyl-L-threonyl-L-alanyl-L-glutaminyl-L-glutamyl-L-leucyl-L-aspartic acid--acetic acid (1/1)