XY-69 (triethylamine)

cas: 2770684-26-7 — see every product listed under this CAS number, including other names

XY-69 (triethylamine) (CAS 2770684-26-7) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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cas2770684-26-7
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Structural formula: {0} (CAS {1})

N,N-diethylethanamine;[(2R)-1-[6-[(3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carbonyl)amino]hexanoyloxy]-3-[[(1R,2S,3R,4R,5S,6R)-2-[4-[2-[[4-[[4-(dimethylamino)phenyl]diazenyl]benzoyl]amino]ethoxy]butoxy]-5,6-dihydroxy-3,4-diphosphonooxycyclohexyl]oxy-hydroxyphosphoryl]oxypropan-2-yl] hexadecanoate (CAS 2770684-26-7) is a chemical compound with the molecular formula C79H113N6O27P3 and a molecular weight of 1671.7 g/mol. IUPAC name: N,N-diethylethanamine;[(2R)-1-[6-[(3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carbonyl)amino]hexanoyloxy]-3-[[(1R,2S,3R,4R,5S,6R)-2-[4-[2-[[4-[[4-(dimethylamino)phenyl]diazenyl]benzoyl]amino]ethoxy]butoxy]-5,6-dihydroxy-3,4-diphosphonooxycyclohexyl]oxy-hydroxyphosphoryl]oxypropan-2-yl] hexadecanoate. InChIKey: HZGAMMOQXYHKJX-LVZMSOTQSA-N.

Identity
Molecular formulaC79H113N6O27P3
Molecular weight1671.7 g/mol
IUPAC nameN,N-diethylethanamine;[(2R)-1-[6-[(3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carbonyl)amino]hexanoyloxy]-3-[[(1R,2S,3R,4R,5S,6R)-2-[4-[2-[[4-[[4-(dimethylamino)phenyl]diazenyl]benzoyl]amino]ethoxy]butoxy]-5,6-dihydroxy-3,4-diphosphonooxycyclohexyl]oxy-hydroxyphosphoryl]oxypropan-2-yl] hexadecanoate
InChIKeyHZGAMMOQXYHKJX-LVZMSOTQSA-N
SMILESCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCNC(=O)C1=CC2=C(C=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O)COP(=O)(O)O[C@@H]6[C@@H]([C@@H]([C@H]([C@@H]([C@H]6OCCCCOCCNC(=O)C7=CC=C(C=C7)N=NC8=CC=C(C=C8)N(C)C)OP(=O)(O)O)OP(=O)(O)O)O)O.CCN(CC)CC

Computed by PubChem (NCBI)

Synonyms: orb3144907

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