Home Carbonyls 8-Methoxycarbonyloctyl-2-deoxy-2-phthalimido-4,6-O-(methoxybenzylidene)-β-D-glucopyranoside

8-Methoxycarbonyloctyl-2-deoxy-2-phthalimido-4,6-O-(methoxybenzylidene)-β-D-glucopyranoside

CAS No.:
359436-88-7
Catalog Number:
AG007D91
Molecular Formula:
C32H39NO10
Molecular Weight:
597.6528
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Product Description
Catalog Number:
AG007D91
Chemical Name:
8-Methoxycarbonyloctyl-2-deoxy-2-phthalimido-4,6-O-(methoxybenzylidene)-β-D-glucopyranoside
CAS Number:
359436-88-7
Molecular Formula:
C32H39NO10
Molecular Weight:
597.6528
MDL Number:
MFCD02094275
IUPAC Name:
methyl 9-[[7-(1,3-dioxoisoindol-2-yl)-8-hydroxy-2-(4-methoxyphenyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]nonanoate
InChI:
InChI=1S/C32H39NO10/c1-38-21-16-14-20(15-17-21)31-41-19-24-28(43-31)27(35)26(33-29(36)22-11-8-9-12-23(22)30(33)37)32(42-24)40-18-10-6-4-3-5-7-13-25(34)39-2/h8-9,11-12,14-17,24,26-28,31-32,35H,3-7,10,13,18-19H2,1-2H3
InChI Key:
FQOYSSBKHUIEBE-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCCCCCOC1OC2COC(OC2C(C1N1C(=O)c2c(C1=O)cccc2)O)c1ccc(cc1)OC
Properties
Complexity:
915  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
597.257g/mol
Formal Charge:
0
Heavy Atom Count:
43  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
597.661g/mol
Monoisotopic Mass:
597.257g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
6  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties