4-Nitrophenyl 4,6-ethylidene-a-D-maltoheptaoside

Base Information

• Chemical Name: 4-Nitrophenyl 4,6-ethylidene-a-D-maltoheptaoside
• CAS No.: 96597-16-9
• Molecular Formula: C50H77 N O38
• Molecular Weight: 1300.13
• Hs Code.: 29389090
• Nikkaji Number: J2.706.282B
• Mol file: 96597-16-9.mol

Synonyms:4-Nitrophenyl 4,6-ethylidene-a-D-maltoheptaoside;96597-16-9;Ethylidene-4-nitrophenyl-a-D-Maltoheptaoside;HY-112835;CS-0066482;4-Nitrophenyl 4-O-[4-O-[4-O-[4-O-[4-O-[4-O-(4-O,6-O-ethylidene-alpha-D-glucopyranosyl)-alpha-D-glucopyranosyl]-alpha-D-glucopyranosyl]-alpha-D-glucopyranosyl]-alpha-D-glucopyranosyl]-alpha-D-glucopyranosyl]-alpha-D-glucopyranoside

Chemical Property of 4-Nitrophenyl 4,6-ethylidene-a-D-maltoheptaoside

Chemical Property:

• PKA: 12.43±0.70(Predicted)
• PSA: 598.10000
• Density: 1.80±0.1 g/cm3(Predicted)
• LogP: -12.34990
• XLogP3: -12.5
• Hydrogen Bond Donor Count: 20
• Hydrogen Bond Acceptor Count: 38
• Rotatable Bond Count: 20
• Exact Mass: 1299.4123570
• Heavy Atom Count: 89
• Complexity: 2190

Purity/Quality:

99% ^*data from raw suppliers

4-Nitrophenyl 4,6-ethylidene-a-D-maltoheptaoside ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

Useful:

• Canonical SMILES: CC1OCC2C(O1)C(C(C(O2)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(C(C8O)O)OC9=CC=C(C=C9)[N+](=O)[O-])CO)CO)CO)CO)CO)CO)O)O
• Isomeric SMILES: CC1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@H](O2)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@@H]([C@@H]([C@H]7O)O)O[C@@H]8[C@H](O[C@@H]([C@@H]([C@H]8O)O)OC9=CC=C(C=C9)[N+](=O)[O-])CO)CO)CO)CO)CO)CO)O)O
• Uses: 4-Nitrophenyl 4,6-ethylidene-a-D-maltoheptaoside is an oligosaccharide used as a substrate for the enzyme α-?amylase in the detection of α-?amylase in pre-?harvest sprouted wheat.