Pyrene-PEG5-biotin
HIT212668284
sdf文件结构编辑类似物检索
HIT ID: HIT212668284
Cas No:
分子式: C39H50N4O8S
分子量: 734.91
常用名: Pyrene-PEG5-biotin
氢键受体数 (HBA): 8
氢键供体数 (HBD): 4
LogP: 2.6879985
IUPAC: 5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-{17-[(pyren-1-yl)formamido]-3,6,9,12,15-pentaoxaheptadecan-1-yl}pentanamide
IUPAC: 5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]-N-{17-[(pyren-1-yl)formamido]-3,6,9,12,15-pentaoxaheptadecan-1-yl}pentanamide
SMILES: [H][C@]12CS[C@@H](CCCCC(=O)NCCOCCOCCOCCOCCOCCNC(=O)c3ccc4ccc5cccc6ccc3c4c56)[C@@]1([H])NC(=O)N2
SMILES: [H][C@]12CS[C@@H](CCCCC(=O)NCCOCCOCCOCCOCCOCCNC(=O)c3ccc4ccc5cccc6ccc3c4c56)[C@@]1([H])NC(=O)N2
InChI key: ODIVXJVCOCDDJO-BMQPFVSWSA-N
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