Home Other Building Blocks Calcium (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioate tetrahydrate

Calcium (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioate tetrahydrate

CAS No.:
5793-89-5
Catalog Number:
AG00E90I
Molecular Formula:
C6H16CaO12
Molecular Weight:
320.2620
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$39
- +
5g
98%
In Stock USA
United States
$60
- +
25g
98%
In Stock USA
United States
$126
- +
Product Description
Catalog Number:
AG00E90I
Chemical Name:
Calcium (2R,3S,4S,5S)-2,3,4,5-tetrahydroxyhexanedioate tetrahydrate
CAS Number:
5793-89-5
Molecular Formula:
C6H16CaO12
Molecular Weight:
320.2620
MDL Number:
MFCD00043409
IUPAC Name:
calcium;(2S,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanedioate;tetrahydrate
InChI:
InChI=1S/C6H10O8.Ca.4H2O/c7-1(3(9)5(11)12)2(8)4(10)6(13)14;;;;;/h1-4,7-10H,(H,11,12)(H,13,14);;4*1H2/q;+2;;;;/p-2/t1-,2-,3-,4+;;;;;/m0...../s1
InChI Key:
ZQWFSIZRQANUDA-WQMSYZFBSA-L
SMILES:
O[C@H]([C@H](C(=O)[O-])O)[C@@H]([C@@H](C(=O)[O-])O)O.[Ca+2].O.O.O.O
UNII:
6AP9J91K4V
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
6  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
320.027g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
8  
Isotope Atom Count:
0
Molecular Weight:
320.26g/mol
Monoisotopic Mass:
320.027g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
165A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
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