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159922-68-6

159922-68-6 | β-D-Galactopyranoside, 4-methoxyphenyl 3,4-O-(1-methylethylidene)-2,6-bis-O-(phenylmethyl)-

CAS No: 159922-68-6 Catalog No: AG001RJ1 MDL No:MFCD06797144

Product Description

Catalog Number:
AG001RJ1
Chemical Name:
β-D-Galactopyranoside, 4-methoxyphenyl 3,4-O-(1-methylethylidene)-2,6-bis-O-(phenylmethyl)-
CAS Number:
159922-68-6
Molecular Formula:
C30H34O7
Molecular Weight:
506.5868
MDL Number:
MFCD06797144
IUPAC Name:
(3aS,4R,6S,7R,7aS)-6-(4-methoxyphenoxy)-2,2-dimethyl-7-phenylmethoxy-4-(phenylmethoxymethyl)-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran
InChI:
InChI=1S/C30H34O7/c1-30(2)36-26-25(20-32-18-21-10-6-4-7-11-21)35-29(34-24-16-14-23(31-3)15-17-24)28(27(26)37-30)33-19-22-12-8-5-9-13-22/h4-17,25-29H,18-20H2,1-3H3/t25-,26+,27+,28-,29-/m1/s1
InChI Key:
PGZOKVMOUQDWPV-JYJZCUDQSA-N
SMILES:
COc1ccc(cc1)O[C@@H]1O[C@H](COCc2ccccc2)[C@H]2[C@@H]([C@H]1OCc1ccccc1)OC(O2)(C)C

Properties

Complexity:
667  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
506.23g/mol
Formal Charge:
0
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
506.595g/mol
Monoisotopic Mass:
506.23g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  

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