Benzylated Cycloisomaltotetraose
[CAS# 153440-04-1]

Identification

• Name: Benzylated Cycloisomaltotetraose
• Molecular Formula: C₁₀₈H₁₁₂O₂₀
• Molecular Weight: 1730.06
• CAS Registry Number: 153440-04-1
• SMILES: [C@H]3%17O[C@@H]([C@@H](OCC1=CC=CC=C1)[C@H](OCC2=CC=CC=C2)[C@H]3OCC4=CC=CC=C4)CO[C@H]7O[C@@H]([C@@H](OCC5=CC=CC=C5)[C@H](OCC6=CC=CC=C6)[C@H]7OCC8=CC=CC=C8)CO[C@H]%11O[C@@H]([C@@H](OCC9=CC=CC=C9)[C@H](OCC%10=CC=CC=C%10)[C@H]%11OCC%12=CC=CC=C%12)CO[C@H]%15O[C@@H]([C@@H](OCC%13=CC=CC=C%13)[C@H](OCC%14=CC=CC=C%14)[C@H]%15OCC%16=CC=CC=C%16)CO%17
• InChI: 1S/C108H112O20/c1-13-37-77(38-14-1)61-109-93-89-73-121-106-102(118-70-86-55-31-10-32-56-86)98(114-66-82-47-23-6-24-48-82)95(111-63-79-41-17-3-18-42-79)91(126-106)75-123-108-104(120-72-88-59-35-12-36-60-88)100(116-68-84-51-27-8-28-52-84)96(112-64-80-43-19-4-20-44-80)92(128-108)76-124-107-103(119-71-87-57-33-11-34-58-87)99(115-67-83-49-25-7-26-50-83)94(110-62-78-39-15-2-16-40-78)90(127-107)74-122-105(125-89)101(117-69-85-53-29-9-30-54-85)97(93)113-65-81-45-21-5-22-46-81/h1-60,89-108H,61-76H2/t89-,90-,91-,92-,93-,94-,95-,96-,97+,98+,99+,100+,101-,102-,103-,104-,105+,106+,107+,108+/m1/s1
• InChIKey: VNWXTHBSGJGSKF-QRXURSOLSA-N

Properties

• Density: 1.29g/cm³ (Cal.)