Products 444997-11-9

CAS 444997-11-9 appears in our catalog under these names: 1–Palmitoyl–2–13(S)–HpODE–sn–glycero–3–PC, 1-Palmitoyl-2-13(S)-HpODE-sn-glycero-3-PC. Offered by: GLPBio, MedChemExpress. Available pack sizes: 100μg, 50μg, 500μg, Get quote.

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

[(2R)-3-hexadecanoyloxy-2-[(9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate (CAS 444997-11-9) is a chemical compound with the molecular formula C42H80NO10P and a molecular weight of 790.1 g/mol. IUPAC name: [(2R)-3-hexadecanoyloxy-2-[(9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate. InChIKey: GMJLRVXYZZADNS-CZPAHNRFSA-N.

Identity
Molecular formulaC42H80NO10P
Molecular weight790.1 g/mol
IUPAC name[(2R)-3-hexadecanoyloxy-2-[(9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
InChIKeyGMJLRVXYZZADNS-CZPAHNRFSA-N
SMILESCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C=C\[C@H](CCCCC)OO

Computed by PubChem (NCBI)