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Home > Nitro Compounds > 74173-31-2
74173-31-2 | 4-NITROPHENYL-ALPHA-D-MALTOHEPTAOSIDE
CAS No: 74173-31-2 Catalog No: AG00FBEP MDL No:
Product Description
Catalog Number:
AG00FBEP
Chemical Name:
4-NITROPHENYL-ALPHA-D-MALTOHEPTAOSIDE
CAS Number:
74173-31-2
IUPAC Name:
(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-6-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C48H75NO38/c50-5-14-21(57)22(58)29(65)43(75-14)82-37-16(7-52)77-45(31(67)24(37)60)84-39-18(9-54)79-47(33(69)26(39)62)86-41-20(11-56)81-48(35(71)28(41)64)87-40-19(10-55)80-46(34(70)27(40)63)85-38-17(8-53)78-44(32(68)25(38)61)83-36-15(6-51)76-42(30(66)23(36)59)74-13-3-1-12(2-4-13)49(72)73/h1-4,14-48,50-71H,5-11H2/t14-,15-,16-,17-,18-,19-,20-,21-,22+,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42+,43-,44-,45-,46-,47-,48-/m1/s1
InChI Key:
FSRMLWKBCQFLJA-HTZQGQHSSA-N
EC Number:
277-741-3
Properties
Complexity:
2110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
35
Defined Bond Stereocenter Count:
0
Exact Mass:
1273.397g/mol
Formal Charge:
0
Heavy Atom Count:
87
Hydrogen Bond Acceptor Count:
38
Hydrogen Bond Donor Count:
22
Isotope Atom Count:
0
Molecular Weight:
1274.097g/mol
Monoisotopic Mass:
1273.397g/mol
Rotatable Bond Count:
21
Topological Polar Surface Area:
620A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-13.3
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