Home Other Building Blocks 9-Amino minocycline, HCl

9-Amino minocycline, HCl

CAS No.:
149934-21-4
Catalog Number:
AG001M59
Molecular Formula:
C23H29ClN4O7
Molecular Weight:
508.9520
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG001M59
Chemical Name:
9-Amino minocycline, HCl
CAS Number:
149934-21-4
Molecular Formula:
C23H29ClN4O7
Molecular Weight:
508.9520
MDL Number:
MFCD00919549
IUPAC Name:
(4S,4aS,5aR,12aR)-9-amino-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrochloride
InChI:
InChI=1S/C23H28N4O7.ClH/c1-26(2)12-7-11(24)17(28)14-9(12)5-8-6-10-16(27(3)4)19(30)15(22(25)33)21(32)23(10,34)20(31)13(8)18(14)29;/h7-8,10,16,28-29,32,34H,5-6,24H2,1-4H3,(H2,25,33);1H/t8-,10-,16-,23-;/m0./s1
InChI Key:
MQRUQMWLTBRONP-KBTHSJHISA-N
SMILES:
CN([C@@H]1C(=C(C(=O)N)C(=O)[C@@]2([C@H]1C[C@@H]1Cc3c(cc(c(c3C(=O)C1=C2O)O)N)N(C)C)O)O)C.Cl
EC Number:
604-710-7
Properties
Complexity:
1010  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
508.172g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
7  
Isotope Atom Count:
0
Molecular Weight:
508.956g/mol
Monoisotopic Mass:
508.172g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
191A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties