200,000+ products from a single source!
sales@angenechem.com
137908-78-2 | Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt
CAS No: 137908-78-2 Catalog No: AG001437 MDL No:
Product Description
Catalog Number:
AG001437
Chemical Name:
Ethanaminium, 2-(diphenylmethoxy)-N-β-D-glucopyranuronosyl-N,N-dimethyl-, inner salt
CAS Number:
137908-78-2
Molecular Formula:
C23H29NO7
Molecular Weight:
431.4789
IUPAC Name:
(2S,3S,4S,5R,6R)-6-[2-benzhydryloxyethyl(dimethyl)azaniumyl]-3,4,5-trihydroxyoxane-2-carboxylate
InChI:
InChI=1S/C23H29NO7/c1-24(2,22-19(27)17(25)18(26)21(31-22)23(28)29)13-14-30-20(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17-22,25-27H,13-14H2,1-2H3/t17-,18-,19+,21-,22+/m0/s1
InChI Key:
OAIGZXXQYIJBLR-WJJPVSRMSA-N
SMILES:
[O-]C(=O)[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)[N+](CCOC(c1ccccc1)c1ccccc1)(C)C
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
431.194g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
431.485g/mol
Monoisotopic Mass:
431.194g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.