Products 3091879-57-8

CAS 3091879-57-8 is the registry number for 14:0-6:0(C2 NBD) PI(4,5)P2 (TEA). Offered by: MedChemExpress. Available pack sizes: Get quote.

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

N,N-diethylethanamine;[(2R)-3-[hydroxy-[(1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-diphosphonooxycyclohexyl]oxyphosphoryl]oxy-2-[6-[[2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]acetyl]amino]hexanoyloxy]propyl] tetradecanoate (CAS 3091879-57-8) is a chemical compound with the molecular formula C43H77N6O23P3 and a molecular weight of 1139.0 g/mol. IUPAC name: N,N-diethylethanamine;[(2R)-3-[hydroxy-[(1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-diphosphonooxycyclohexyl]oxyphosphoryl]oxy-2-[6-[[2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]acetyl]amino]hexanoyloxy]propyl] tetradecanoate. InChIKey: ZRRKGJVTLYSRSJ-AMJHQDLMSA-N.

Identity
Molecular formulaC43H77N6O23P3
Molecular weight1139.0 g/mol
IUPAC nameN,N-diethylethanamine;[(2R)-3-[hydroxy-[(1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-diphosphonooxycyclohexyl]oxyphosphoryl]oxy-2-[6-[[2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]acetyl]amino]hexanoyloxy]propyl] tetradecanoate
InChIKeyZRRKGJVTLYSRSJ-AMJHQDLMSA-N
SMILESCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1O)OP(=O)(O)O)OP(=O)(O)O)O)O)OC(=O)CCCCCNC(=O)CNC2=CC=C(C3=NON=C23)[N+](=O)[O-].CCN(CC)CC

Computed by PubChem (NCBI)

Synonyms: orb3136559