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[2-hexanoyloxy-3-[oxidanyl-[2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]oxy-phosphoryl]oxy-propyl] 6-[2-[2-[2-[2-[2-[3-oxidanylidene-3-[[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]methylamino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxycarbonylamino]hexanoate

[2-hexanoyloxy-3-[oxidanyl-[2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]oxy-phosphoryl]oxy-propyl] 6-[2-[2-[2-[2-[2-[3-oxidanylidene-3-[[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]methylamino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxycarbonylamino]hexanoate

Systemtic Name:[2-hexanoyloxy-3-[oxidanyl-[2,3,4,5,6-pentakis(oxidanyl)cyclohexyl]oxy-phosphoryl]oxy-propyl] 6-[2-[2-[2-[2-[2-[3-oxidanylidene-3-[[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]methylamino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxycarbonylamino]hexanoate
Openeye Name:[2-hexanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexoxy)phosphoryl]oxy-propyl] 6-[2-[2-[2-[2-[2-[3-oxo-3-[[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]methylamino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxycarbonylamino]hexanoate
CAS Name:6-[[oxo-[2-[2-[2-[2-[2-[3-oxo-3-[[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]methylamino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]methyl]amino]hexanoic acid [3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-2-(1-oxohexoxy)propyl] ester
IUPAC Name:[2-hexanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropyl] 6-[2-[2-[2-[2-[2-[3-oxo-3-[[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]methylamino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxycarbonylamino]hexanoate
Traditional Name:6-[2-[2-[2-[2-[2-[3-keto-3-[[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]benzyl]amino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxycarbonylamino]hexanoic acid [2-caproyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexoxy)phosphoryl]oxy-propyl] ester
Formula: C56H79N4O22P
MolecularWeight: 1191.213821
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(COC(=O)CCCCCNC(=O)OCCOCCOCCOCCOCCOCCC(=O)NCC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C4=CC=CC=C4)COP(=O)(O)OC5C(C(C(C(C5O)O)O)O)O


Isomeric SMILES

CCCCCC(=O)OC(COC(=O)CCCCCNC(=O)OCCOCCOCCOCCOCCOCCC(=O)NCC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C4=CC=CC=C4)COP(=O)(O)OC5C(C(C(C(C5O)O)O)O)O


InChI

InChI=1S/C56H79N4O22P/c1-2-3-6-14-47(63)80-44(38-79-83(70,71)82-53-51(67)49(65)48(64)50(66)52(53)68)37-78-46(62)13-9-5-10-24-57-56(69)77-35-34-76-33-32-75-31-30-74-29-28-73-27-26-72-25-23-45(61)58-36-39-15-17-42(18-16-39)54-59-60-55(81-54)43-21-19-41(20-22-43)40-11-7-4-8-12-40/h4,7-8,11-12,15-22,44,48-53,64-68H,2-3,5-6,9-10,13-14,23-38H2,1H3,(H,57,69)(H,58,61)(H,70,71)


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