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73304-29-7 | N-[4-[2-(2,5-dioxo-4-phenylimidazolidin-4-yl)phenoxy]butyl]-7-(beta-D-galactopyranosyloxy)-2-oxo-2H-1-benzopyran-3-carboxamide
CAS No: 73304-29-7 Catalog No: AG00FW3N MDL No:
Product Description
Catalog Number:
AG00FW3N
Chemical Name:
N-[4-[2-(2,5-dioxo-4-phenylimidazolidin-4-yl)phenoxy]butyl]-7-(beta-D-galactopyranosyloxy)-2-oxo-2H-1-benzopyran-3-carboxamide
CAS Number:
73304-29-7
IUPAC Name:
N-[4-[2-(2,5-dioxo-4-phenylimidazolidin-4-yl)phenoxy]butyl]-2-oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromene-3-carboxamide
InChI:
InChI=1S/C35H35N3O12/c39-18-26-27(40)28(41)29(42)32(50-26)48-21-13-12-19-16-22(31(44)49-25(19)17-21)30(43)36-14-6-7-15-47-24-11-5-4-10-23(24)35(20-8-2-1-3-9-20)33(45)37-34(46)38-35/h1-5,8-13,16-17,26-29,32,39-42H,6-7,14-15,18H2,(H,36,43)(H2,37,38,45,46)/t26-,27+,28+,29-,32-,35?/m1/s1
InChI Key:
RESQEYQRUVHAAG-YOFKTBMVSA-N
EC Number:
277-373-3
Properties
Complexity:
1280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
689.222g/mol
Formal Charge:
0
Heavy Atom Count:
50
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
689.674g/mol
Monoisotopic Mass:
689.222g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
222A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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