Products 2773415-17-9
CAS 2773415-17-9 is the registry number for XB010 drug-linker. Offered by: MedChemExpress. Available pack sizes: Get quote.
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-[[[(2S)-1-[[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-methylcarbamoyl]oxymethyl]-2-[[(2S)-2-[[(2S)-3-methyl-2-[3-[2-[2-[[(2R)-2-[3-[2-[[methyl(methylamino)amino]methyl]pyrrolo[2,3-b]pyridin-1-yl]propanoylamino]-3-sulfopropanoyl]amino]ethoxy]ethoxy]propanoylamino]butanoyl]amino]propanoyl]amino]phenoxy]oxane-2-carboxylic acid (CAS 2773415-17-9) is a chemical compound with the molecular formula C84H130N14O26S and a molecular weight of 1784.1 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-[[[(2S)-1-[[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-methylcarbamoyl]oxymethyl]-2-[[(2S)-2-[[(2S)-3-methyl-2-[3-[2-[2-[[(2R)-2-[3-[2-[[methyl(methylamino)amino]methyl]pyrrolo[2,3-b]pyridin-1-yl]propanoylamino]-3-sulfopropanoyl]amino]ethoxy]ethoxy]propanoylamino]butanoyl]amino]propanoyl]amino]phenoxy]oxane-2-carboxylic acid. InChIKey: WOFNOMZTQGXATB-SNOFXNALSA-N.
| Molecular formula | C84H130N14O26S |
|---|---|
| Molecular weight | 1784.1 g/mol |
| IUPAC name | (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-[[[(2S)-1-[[(2S)-1-[[(3R,4S,5S)-1-[(2S)-2-[(1R,2R)-3-[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-methylcarbamoyl]oxymethyl]-2-[[(2S)-2-[[(2S)-3-methyl-2-[3-[2-[2-[[(2R)-2-[3-[2-[[methyl(methylamino)amino]methyl]pyrrolo[2,3-b]pyridin-1-yl]propanoylamino]-3-sulfopropanoyl]amino]ethoxy]ethoxy]propanoylamino]butanoyl]amino]propanoyl]amino]phenoxy]oxane-2-carboxylic acid |
| InChIKey | WOFNOMZTQGXATB-SNOFXNALSA-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](C)[C@H](C2=CC=CC=C2)O)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)OCC3=CC(=C(C=C3)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)CCOCCOCCNC(=O)[C@H](CS(=O)(=O)O)NC(=O)CCN4C(=CC5=C4N=CC=C5)CN(C)NC)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O |
Computed by PubChem (NCBI)
Synonyms:
orb3174919