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1146197-36-5 | L-lyxo-Hex-5-enofuranose, 5,6-dideoxy-4-C-[(phenylmethoxy)methyl]-3-O-(phenylmethyl)-, 1,2-diacetate
CAS No: 1146197-36-5 Catalog No: AG000EUD MDL No:
Product Description
Catalog Number:
AG000EUD
Chemical Name:
L-lyxo-Hex-5-enofuranose, 5,6-dideoxy-4-C-[(phenylmethoxy)methyl]-3-O-(phenylmethyl)-, 1,2-diacetate
CAS Number:
1146197-36-5
Molecular Formula:
C25H28O7
Molecular Weight:
440.4856
IUPAC Name:
[(3R,4S,5R)-2-acetyloxy-5-ethenyl-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-3-yl] acetate
InChI:
InChI=1S/C25H28O7/c1-4-25(17-28-15-20-11-7-5-8-12-20)23(29-16-21-13-9-6-10-14-21)22(30-18(2)26)24(32-25)31-19(3)27/h4-14,22-24H,1,15-17H2,2-3H3/t22-,23+,24?,25-/m1/s1
InChI Key:
ASKJAQWLLAHJKD-DVMHTGGUSA-N
SMILES:
C=C[C@]1(COCc2ccccc2)OC([C@@H]([C@@H]1OCc1ccccc1)OC(=O)C)OC(=O)C
Properties
Complexity:
624
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
440.184g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
440.492g/mol
Monoisotopic Mass:
440.184g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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