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10101-21-0 | D-Gluconic acid, strontium salt (2:1)
CAS No: 10101-21-0 Catalog No: AG0003I9 MDL No:
Product Description
Catalog Number:
AG0003I9
Chemical Name:
D-Gluconic acid, strontium salt (2:1)
CAS Number:
10101-21-0
Molecular Formula:
C12H22O14Sr
Molecular Weight:
477.9147
IUPAC Name:
strontium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate
InChI:
InChI=1S/2C6H12O7.Sr/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;/h2*2-5,7-11H,1H2,(H,12,13);/q;;+2/p-2/t2*2-,3-,4+,5-;/m11./s1
InChI Key:
QRVYVKGHSWMAJI-IYEMJOQQSA-L
SMILES:
OC[C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O.OC[C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O.[Sr+2]
EC Number:
233-249-0
UNII:
14V82624AW
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
8
Defined Bond Stereocenter Count:
0
Exact Mass:
478.007g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
10
Isotope Atom Count:
0
Molecular Weight:
477.914g/mol
Monoisotopic Mass:
478.007g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
283A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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