CAS: 15596-27-7 - D-Mannitol, 1,2,3,4,5,6-hexa-3-pyridinecarboxylate

Fórmula:C₄₂H₃₂N₆O₁₂

InChI:InChI=1S/C42H32N6O12/c49-37(27-7-1-13-43-19-27)55-25-33(57-39(51)29-9-3-15-45-21-29)35(59-41(53)31-11-5-17-47-23-31)36(60-42(54)32-12-6-18-48-24-32)34(58-40(52)30-10-4-16-46-22-30)26-56-38(50)28-8-2-14-44-20-28/h1-24,33-36H,25-26H2/t33-,34-,35-,36-/m1/s1

Chave InChI:InChIKey=IMRLNFKFNFLWQF-MGXDLYCJSA-N

SMILES:O=C(OCC(OC(=O)C=1C=NC=CC1)C(OC(=O)C=2C=NC=CC2)C(OC(=O)C=3C=NC=CC3)C(OC(=O)C=4C=NC=CC4)COC(=O)C=5C=NC=CC5)C=6C=NC=CC6

Sinónimos:
[(1R,2R,3R,4R)-2,3,4,5-tetrakis(pyridine-3-carbonyloxy)-1-(pyridine-3-carbonyloxymethyl)pentyl] pyridine-3-carboxylate
D-Mannitol, hexa-3-pyridinecarboxylate
Mannitol, hexanicotinate, D-
D-Mannitol, 1,2,3,4,5,6-hexa-3-pyridinecarboxylate
D-Mannitol hexanicotinate