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80321-98-8 | P-NITROPHENYL 6-O-B-D-GALACTOPYRANOSYL-B -D-GALACTO
CAS No: 80321-98-8 Catalog No: AG00GJ6S MDL No:
Product Description
Catalog Number:
AG00GJ6S
Chemical Name:
P-NITROPHENYL 6-O-B-D-GALACTOPYRANOSYL-B -D-GALACTO
CAS Number:
80321-98-8
IUPAC Name:
(2R,3R,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-(4-nitrophenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
InChI:
InChI=1S/C18H25NO13/c20-5-9-11(21)13(23)15(25)17(31-9)29-6-10-12(22)14(24)16(26)18(32-10)30-8-3-1-7(2-4-8)19(27)28/h1-4,9-18,20-26H,5-6H2/t9-,10-,11+,12+,13+,14+,15-,16-,17-,18-/m1/s1
InChI Key:
ISCYUJSLZREARS-RZWXNVOYSA-N
Properties
Complexity:
612
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
10
Defined Bond Stereocenter Count:
0
Exact Mass:
463.133g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
463.392g/mol
Monoisotopic Mass:
463.133g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
224A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.6
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