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18006-25-2 | α-D-Glucofuranose, 1,2-O-(1-methylethylidene)-3-O-(phenylmethyl)-, 5,6-diacetate
CAS No: 18006-25-2 Catalog No: AG0021O0 MDL No:
Product Description
Catalog Number:
AG0021O0
Chemical Name:
α-D-Glucofuranose, 1,2-O-(1-methylethylidene)-3-O-(phenylmethyl)-, 5,6-diacetate
CAS Number:
18006-25-2
Molecular Formula:
C36H74O
Molecular Weight:
522.9722
IUPAC Name:
[(2R)-2-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-phenylmethoxy-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-acetyloxyethyl] acetate
InChI:
InChI=1S/C20H26O8/c1-12(21)23-11-15(25-13(2)22)16-17(24-10-14-8-6-5-7-9-14)18-19(26-16)28-20(3,4)27-18/h5-9,15-19H,10-11H2,1-4H3/t15-,16-,17+,18-,19-/m1/s1
InChI Key:
CIMPUIMAKYLKBF-UJWQCDCRSA-N
SMILES:
CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)CO
Properties
Complexity:
556
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
394.163g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
394.42g/mol
Monoisotopic Mass:
394.163g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
89.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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