Products 3028453-70-2
CAS 3028453-70-2 is the registry number for Auristatin S. Offered by: MedChemExpress. Available pack sizes: Get quote.
(2S)-2-[[(2S)-2-(dimethylamino)-3-hydroxypropanoyl]amino]-N-[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N,3-dimethylbutanamide (CAS 3028453-70-2) is a chemical compound with the molecular formula C38H65N5O8 and a molecular weight of 720.0 g/mol. IUPAC name: (2S)-2-[[(2S)-2-(dimethylamino)-3-hydroxypropanoyl]amino]-N-[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N,3-dimethylbutanamide. InChIKey: LTEMWCRPAPDRJZ-ZMRJGPQJSA-N.
| Molecular formula | C38H65N5O8 |
|---|---|
| Molecular weight | 720.0 g/mol |
| IUPAC name | (2S)-2-[[(2S)-2-(dimethylamino)-3-hydroxypropanoyl]amino]-N-[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N,3-dimethylbutanamide |
| InChIKey | LTEMWCRPAPDRJZ-ZMRJGPQJSA-N |
| SMILES | CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)CO)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](CO)N(C)C |
Computed by PubChem (NCBI)
Synonyms:
orb3135892