Products 2845165-06-0
CAS 2845165-06-0 is the registry number for LNK4-S, 96.41%. Offered by: MedChemExpress. Available pack sizes: 10 mg, 1 mg, 5 mg.
2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[(2S)-5-[[(2S)-2-[4-[[(2S)-2-[[(2S)-2-acetamido-3-methylbutanoyl]amino]propanoyl]amino]phenyl]-2-[[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]carbamoyloxy]ethyl]amino]-2-[[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]acetyl]amino]-5-oxopentanoyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetic acid (CAS 2845165-06-0) is a chemical compound with the molecular formula C91H121FN20O28 and a molecular weight of 1962.0 g/mol. IUPAC name: 2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[(2S)-5-[[(2S)-2-[4-[[(2S)-2-[[(2S)-2-acetamido-3-methylbutanoyl]amino]propanoyl]amino]phenyl]-2-[[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]carbamoyloxy]ethyl]amino]-2-[[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]acetyl]amino]-5-oxopentanoyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetic acid. InChIKey: MZPPYJBLZLUJCU-AASQTGCKSA-N.
| Molecular formula | C91H121FN20O28 |
|---|---|
| Molecular weight | 1962.0 g/mol |
| IUPAC name | 2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[(2S)-5-[[(2S)-2-[4-[[(2S)-2-[[(2S)-2-acetamido-3-methylbutanoyl]amino]propanoyl]amino]phenyl]-2-[[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]carbamoyloxy]ethyl]amino]-2-[[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]acetyl]amino]-5-oxopentanoyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetyl]-methylamino]acetic acid |
| InChIKey | MZPPYJBLZLUJCU-AASQTGCKSA-N |
| SMILES | CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C5[C@H](CCC6=C5C(=CC(=C6C)F)N=C4C3=C2)NC(=O)O[C@H](CNC(=O)CC[C@@H](C(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)O)NC(=O)COCCOCCNC(=O)CCN7C(=O)C=CC7=O)C8=CC=C(C=C8)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)C)O |
Computed by PubChem (NCBI)
Synonyms:
Mipitecan (USAN), orb2814649