HIT ID: HIT212668497
Cas No: 2086689-02-1
分子式: C19H31N3O8S
分子量: 461.53
常用名: 2-(Biotin-amido)-1,3-bis-(C1-PEG1-acid)
常用名: 2-(Biotin-amido)-1,3-bis-(C1-PEG1-acid)
氢键受体数 (HBA): 8
氢键供体数 (HBD): 5
LogP: -0.8680348
IUPAC: 3-(2-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-3-(2-carboxyethoxy)propoxy)propanoic acid
IUPAC: 3-(2-{5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamido}-3-(2-carboxyethoxy)propoxy)propanoic acid
SMILES: [H][C@]12CS[C@@H](CCCCC(=O)NC(COCCC(O)=O)COCCC(O)=O)[C@@]1([H])NC(=O)N2
SMILES: [H][C@]12CS[C@@H](CCCCC(=O)NC(COCCC(O)=O)COCCC(O)=O)[C@@]1([H])NC(=O)N2
InChI key: NRIDXCVOVMVZJD-DEYYWGMASA-N
