Products 2222981-66-8
CAS 2222981-66-8 is the registry number for MC7. Offered by: MedChemExpress. Available pack sizes: Get quote.
(2S,3S,4S,5R,6S)-6-[2-[3-[[(2S)-3-amino-2-(2,5-dioxopyrrol-1-yl)propanoyl]amino]propanoylamino]-4-[[3-[4-[4-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butyl]piperidine-1-carbonyl]phenyl]carbamoyloxymethyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 2222981-66-8) is a chemical compound with the molecular formula C48H56N8O15 and a molecular weight of 985.0 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[2-[3-[[(2S)-3-amino-2-(2,5-dioxopyrrol-1-yl)propanoyl]amino]propanoylamino]-4-[[3-[4-[4-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butyl]piperidine-1-carbonyl]phenyl]carbamoyloxymethyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: FDKOVVIYZBOXBG-OCMQEAQLSA-N.
| Molecular formula | C48H56N8O15 |
|---|---|
| Molecular weight | 985.0 g/mol |
| IUPAC name | (2S,3S,4S,5R,6S)-6-[2-[3-[[(2S)-3-amino-2-(2,5-dioxopyrrol-1-yl)propanoyl]amino]propanoylamino]-4-[[3-[4-[4-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]butyl]piperidine-1-carbonyl]phenyl]carbamoyloxymethyl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid |
| InChIKey | FDKOVVIYZBOXBG-OCMQEAQLSA-N |
| SMILES | C1CN(CCC1CCCCNC(=O)/C=C/C2=CN=CC=C2)C(=O)C3=CC(=CC=C3)NC(=O)OCC4=CC(=C(C=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)NC(=O)CCNC(=O)[C@H](CN)N6C(=O)C=CC6=O |
Computed by PubChem (NCBI)