(2-{[3-(hexadecanoyloxy)-2-[(13-hydroperoxyoctadeca-9,11-dienoyl)oxy]propyl phosphonato]oxy}ethyl)trimethylazanium, 1-Palmitoyl-2-13(S)-HpODE-sn-glycero-3-PC
HIT218832844
sdf文件结构编辑类似物检索
HIT ID: HIT218832844
Cas No:
分子式: C42H80NO10P
分子量: 790.073
常用名: (2-{[3-(hexadecanoyloxy)-2-[(13-hydroperoxyoctadeca-9,11-dienoyl)oxy]propyl phosphonato]oxy}ethyl)trimethylazanium, 1-Palmitoyl-2-13(S)-HpODE-sn-glycero-3-PC
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2-{[3-(hexadecanoyloxy)-2-[(13-hydroperoxyoctadeca-9,11-dienoyl)oxy]propyl phosphonato]oxy}ethyl)trimethylazanium
SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CC=CC(CCCCC)OO
InChI key: GMJLRVXYZZADNS-UHFFFAOYSA-N
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