CAS 384835-52-3 16:0 Biotinyl Cap PE (HCID 46907856)

基本情報

CAS: 384835-52-3
標準SMILES: CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)OC(=O)CCCCCCCCCCCCCCC.[Na+]
InChIKey: HLOYGXYDOICSBP-OHXMQTJZSA-M
分子式: C53H98N4NaO11PS
平均分子量: 1,053.4 g/mol
単同位体質量: 1,052.65881241

名称と識別子

優先名称: 16:0 Biotinyl Cap PE
IUPAC: sodium 2-[6-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanoylamino]ethyl [(2R)-2,3-di(hexadecanoyloxy)propyl] phosphate
英語名: 1,2-dipalMitoyl-sn-glycero-3-phosphoethanolaMine-N-(cap biotinyl) (sodiuM salt)
分子式: C53H100N4NaO11PS
分子量: 1055.42

名称と別名

384835-52-316:0 Biotinyl Cap PE1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine-N-(cap biotinyl) (sodium salt)Sodium (R)-2,3-bis(palmitoyloxy)propyl (2-(6-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)hexanamido)ethyl) phosphatesodium;2-[6-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanoylamino]ethyl [(2R)-2,3-di(hexadecanoyloxy)propyl] phosphate1,2-Dipalmitoyl-sn-glycero-3-PE-N-(cap biotin) (sodium salt)orb1693725SCHEMBL29700479DTXSID00677175EX-A54161,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamine-N-(cap biotinyl) (sodium salt)BP-28341

名称をさらに表示

DPPE-cap-BiotineDPPE-cap-Biotinyliotin-Cap-DPPE Na saltBiotin-Cap-DPPE Na saltDPPE cap Biotine (sodium salt)1,2-dihexadecanoyl-sn-glycero-3-phosphoethanolamine-N-(cap biotinyl)(sodium salt)1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine-N-(cap biotinyl) (sodium salt) (POPG)

物性

構造計算による物性

極性表面積: 236 Å²
水素結合供与体数: 4
水素結合受容体数: 12
回転可能結合数: 51
重原子数: 71
形式電荷: 0
複雑度: 1,440

物理化学的性質

貯蔵温度: -20 °C · Store at -20°C
溶解性: DMSO: Slightly Soluble
外見: A solid
InChIKey: LTQZTKIVIBBAFY-PNYSOFIONA-N
SMILES: C([C@@H]1SC[C@]2([H])NC(=O)N[C@]12[H])CCCC(=O)NCCCCCC(=O)NCCOP(O)(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC.[NaH] |&1:1,4,10,34,r|

安全と法規制

安全データ

ストレージクラス: 11 - Combustible Solids

化学と産業

応用分野

使用1,2-Dipalmityl-sn-glycero-3-Phosphoethanolamine-N-(cap biotinyl) Sodium Salt is used in the development of capacitance based immunosensors on mixed self-assembled monolayers for Hb detection.

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化合物ノート

読み込み中…

16:0 Biotinyl Cap PE