Home Other Building Blocks D-Gluconic acid, 4-O-b-D-galactopyranosyl-, calciumsalt (2:1), dihydrate (9CI)

D-Gluconic acid, 4-O-b-D-galactopyranosyl-, calciumsalt (2:1), dihydrate (9CI)

CAS No.:
110638-68-1
Catalog Number:
AG00HBR4
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00HBR4
Chemical Name:
D-Gluconic acid, 4-O-b-D-galactopyranosyl-, calciumsalt (2:1), dihydrate (9CI)
CAS Number:
110638-68-1
MDL Number:
MFCD00135895
IUPAC Name:
calcium;(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate
InChI:
InChI=1S/2C12H22O12.Ca/c2*13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12;/h2*3-10,12-20H,1-2H2,(H,21,22);/q;;+2/p-2/t2*3-,4-,5+,6+,7-,8-,9-,10-,12+;/m11./s1
InChI Key:
RHEMCSSAABKPLI-SQCCMBKESA-L
EC Number:
600-978-4
Properties
Complexity:
892  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
18  
Defined Bond Stereocenter Count:
0
Exact Mass:
754.169g/mol
Formal Charge:
0
Heavy Atom Count:
49  
Hydrogen Bond Acceptor Count:
24  
Hydrogen Bond Donor Count:
16  
Isotope Atom Count:
0
Molecular Weight:
754.654g/mol
Monoisotopic Mass:
754.169g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
441A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties