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207511-08-8 | D-Glucose, O-α-D-glucopyranosyl-(1→4)-O-α-D-glucopyranosyl-(1→4)-, hydrate (9CI)
CAS No: 207511-08-8 Catalog No: AG002J33 MDL No:MFCD00149451
Product Description
Catalog Number:
AG002J33
Chemical Name:
D-Glucose, O-α-D-glucopyranosyl-(1→4)-O-α-D-glucopyranosyl-(1→4)-, hydrate (9CI)
CAS Number:
207511-08-8
MDL Number:
MFCD00149451
IUPAC Name:
(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol;hydrate
InChI:
InChI=1S/C18H32O16.H2O/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24;/h4-29H,1-3H2;1H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14-,15-,16?,17-,18-;/m1./s1
InChI Key:
HNKASWRMLBJLKJ-HNNWOXMSSA-N
Properties
Complexity:
641
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
14
Defined Bond Stereocenter Count:
0
Exact Mass:
522.18g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
17
Hydrogen Bond Donor Count:
12
Isotope Atom Count:
0
Molecular Weight:
522.453g/mol
Monoisotopic Mass:
522.18g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
270A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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