Biotin-PEG3-amine

• CAS: 359860-27-8
• Catalog Number: ACM359860278-1
• Category: Amino PEG Linkers
• Molecular Weight: 418.55
• Molecular Formula: C18H34N4O5S
• Synonyms: N-(2-(2-(2-(2-Aminoethoxy)ethoxy)ethoxy)ethyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
• IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]pentanamide
• SMILES: O=C1N[C@@]([H])([C@]([H])(CS2)N1)[C@@H]2CCCCC(NCCOCCOCCOCCN)=O
• InChI: InChI=1S/C18H34N4O5S/c19-5-7-25-9-11-27-12-10-26-8-6-20-16(23)4-2-1-3-15-17-14(13-28-15)21-18(24)22-17/h14-15,17H,1-13,19H2,(H,20,23)(H2,21,22,24)/t14-,15-,17-/m0/s1
• InChI Key: KIJSBKNJFAUJFV-ZOBUZTSGSA-N
• Storage: Keep in dark place, inert atmosphere, store in freezer, under -20°C
• Complexity: 471
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 3
• Defined Bond Stereocenter Count: 0
• EC Number: 884-847-9
• Formal Charge: 0
• H-Bond Acceptor: 7
• H-Bond Donor: 4
• Heavy Atom Count: 28
• Isomeric SMILES: C1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)NCCOCCOCCOCCN)NC(=O)N2
• MDL Number: MFCD09952640
• PubChem ID: 50896259
• Pubchem SID: 488201451
• Rotatable Bond Count: 16
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0