Account Aminobenzenesulfonic auristatin E
- Catalog No. :
- ACNKGX670
- CAS No. :
- 1800462-99-0
- Molecular Formula :
- C37H64N6O8S
- Molecular Weight :
- 753.02
IUPAC Name:(S)-N-((3R,4S,5S)-1-((S)-2-((1R,2R)-3-((4-aminophenyl)sulfonamido)-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 | Aminobenzenesulfonic auristatin E |
|---|---|
| IUPAC Name | (S)-N-((3R,4S,5S)-1-((S)-2-((1R,2R)-3-((4-aminophenyl)sulfonamido)-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 |
| Molecular Formula | C37H64N6O8S |
| Molecular Weight | 753.02 |
| 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(NS(=O)(C2=CC=C(N)C=C2)=O)=O)CCC1)=O)C)=O |
| InChI Key | AZVFJNPRFUTRNO-RAEOHFLNSA-N |
| Synonym | L-Valinamide, N,N-dimethyl-L-valyl-N-[(1S,2R)-4-[(2S)-2-[(1R,2R)-3-[[(4-aminophenyl)sulfonyl]amino]-1-methoxy-2-methyl-3-oxopropyl]-1-pyrrolidinyl]-2-methoxy-1-[(1S)-1-methylpropyl]-4-oxobutyl]-N-methyl-;Aminobenzenesulfonic auristatin E;D8-Aminobenzenesulfonic auristatin E |
| CAS No. | 1800462-99-0 |
Synthetic Route by SureRoute
2. ACNKGX670 Molecular Building Block Synthetic Route
(S)-N-(4-(N-((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-methylpropanoyl)sulfamoyl)phenyl)-2-((S)-1-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-14-isopropyl-12-oxo-3,6,9-trioxa-13-azapentadecan-15-amido)-5-ureidopentanamide
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