Account Duostatin 5
- Catalog No. :
- ACQJRI602
- CAS No. :
- 2124210-34-8
- Molecular Formula :
- C40H69N9O6
- Molecular Weight :
- 772.05
IUPAC Name:(S)-N-((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((S)-1-(4-aminophenyl)-3-azidopropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)-2-((S)-2-(dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamide
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Product Information
| Product Name | Duostatin 5 |
|---|---|
| IUPAC Name | (S)-N-((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((S)-1-(4-aminophenyl)-3-azidopropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)-2-((S)-2-(dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamide |
| MDL No. | MFCD34604172 |
| Molecular Formula | C40H69N9O6 |
| Molecular Weight | 772.05 |
| SMILES | CC(C)[C@H](NC([C@@H](N(C)C)C(C)C)=O)C(N([C@@H]([C@@H](C)CC)[C@H](OC)CC(N1[C@H]([C@H](OC)[C@@H](C)C(N[C@H](CN=[N+]=[N-])CC2=CC=C(N)C=C2)=O)CCC1)=O)C)=O |
| InChI Key | QIHHTRNUHMRKQK-MNFMTBGBSA-N |
| Synonym | (S)-N-((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((S)-1-(4-aminophenyl)-3-azidopropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)-2-((S)-2-(dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamide;DUO-5;Unii-CE421mmy47;Duostatin 5 |
| CAS No. | 2124210-34-8 |
| PubChem CID | 138320017 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H228-H315-H319
- Precautionary Statement(s)
- P210-P240-P241-P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P370+P378
Synthetic Route by SureRoute
2. ACQJRI602 Molecular Building Block Synthetic Route
Antitumor agent-39
(S)-2-((2R,3R)-3-((S)-1-((3R,4S,5S)-4-((S)-2-((S)-2-(Dimethylamino)-3-methylbutanamido)-N,3-dimethylbutanamido)-3-methoxy-5-methylheptanoyl)pyrrolidin-2-yl)-3-methoxy-2-methylpropanamido)-3-phenylpropanoic acid
AGD-0182