Products 79404-98-1

CAS 79404-98-1 is the registry number for Demethylmacrocin. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

2-[6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-5,9,13-trimethyl-2,10-dioxo-15-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde (CAS 79404-98-1) is a chemical compound with the molecular formula C44H73NO17 and a molecular weight of 888.0 g/mol. IUPAC name: 2-[6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-5,9,13-trimethyl-2,10-dioxo-15-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde. InChIKey: ALZAOGATQMXJKX-UHFFFAOYSA-N.

Identity
Molecular formulaC44H73NO17
Molecular weight888.0 g/mol
IUPAC name2-[6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-5,9,13-trimethyl-2,10-dioxo-15-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
InChIKeyALZAOGATQMXJKX-UHFFFAOYSA-N
SMILESCCC1C(C=C(C=CC(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)C)COC4C(C(C(C(O4)C)O)O)O

Computed by PubChem (NCBI)

Synonyms: orb3024670