Lipid I97

cas: 3046404-81-0 — see every product listed under this CAS number, including other names

Lipid I97 (CAS 3046404-81-0) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas3046404-81-0
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Structural formula: {0} (CAS {1})

5-O-[(3R)-4-[[3-[2-(dimethylamino)ethoxy]-3-oxopropyl]amino]-3-[5-(2-hexyldecoxy)-5-oxopentanoyl]oxy-2,2-dimethyl-4-oxobutyl] 1-O-(2-hexyldecyl) pentanedioate (CAS 3046404-81-0) is a chemical compound with the molecular formula C55H102N2O11 and a molecular weight of 967.4 g/mol. IUPAC name: 5-O-[(3R)-4-[[3-[2-(dimethylamino)ethoxy]-3-oxopropyl]amino]-3-[5-(2-hexyldecoxy)-5-oxopentanoyl]oxy-2,2-dimethyl-4-oxobutyl] 1-O-(2-hexyldecyl) pentanedioate. InChIKey: QWNGWGVVAZJBLB-ORVWFSQNSA-N.

Identity
Molecular formulaC55H102N2O11
Molecular weight967.4 g/mol
IUPAC name5-O-[(3R)-4-[[3-[2-(dimethylamino)ethoxy]-3-oxopropyl]amino]-3-[5-(2-hexyldecoxy)-5-oxopentanoyl]oxy-2,2-dimethyl-4-oxobutyl] 1-O-(2-hexyldecyl) pentanedioate
InChIKeyQWNGWGVVAZJBLB-ORVWFSQNSA-N
SMILESCCCCCCCCC(CCCCCC)COC(=O)CCCC(=O)OCC(C)(C)[C@H](C(=O)NCCC(=O)OCCN(C)C)OC(=O)CCCC(=O)OCC(CCCCCC)CCCCCCCC

Computed by PubChem (NCBI)

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