200,000+ products from a single source!
sales@angenechem.com
23220-74-8 | 2(1H)-Pyridinone, 4-hydroxy-1-(2,3,5-tri-O-benzoyl-β-D-ribofuranosyl)-
CAS No: 23220-74-8 Catalog No: AG002MJV MDL No:
Product Description
Catalog Number:
AG002MJV
Chemical Name:
2(1H)-Pyridinone, 4-hydroxy-1-(2,3,5-tri-O-benzoyl-β-D-ribofuranosyl)-
CAS Number:
23220-74-8
Molecular Formula:
C31H25NO9
Molecular Weight:
555.5315
IUPAC Name:
[(2R,3R,4R,5R)-3,4-dibenzoyloxy-5-(4-hydroxy-2-oxopyridin-1-yl)oxolan-2-yl]methyl benzoate
InChI:
InChI=1S/C31H25NO9/c33-23-16-17-32(25(34)18-23)28-27(41-31(37)22-14-8-3-9-15-22)26(40-30(36)21-12-6-2-7-13-21)24(39-28)19-38-29(35)20-10-4-1-5-11-20/h1-18,24,26-28,33H,19H2/t24-,26-,27-,28-/m1/s1
InChI Key:
GUEPFYBEHGIHIW-YULOIDQLSA-N
SMILES:
Oc1ccn(c(=O)c1)[C@@H]1O[C@@H]([C@H]([C@H]1OC(=O)c1ccccc1)OC(=O)c1ccccc1)COC(=O)c1ccccc1
Properties
Complexity:
1020
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
555.153g/mol
Formal Charge:
0
Heavy Atom Count:
41
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
555.539g/mol
Monoisotopic Mass:
555.153g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.