Gentamicin X2 sulfate EvoPure®

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CAS Number

36889-17-5

Applications

Microbiology.

Purity

>98% by HPLC

Molecular Formula

C19H38N4O10• xH2SO4 (lot specific)

Molecular Weight

482.52 g/mol (Free base)

Shipping Conditions

Ambient

Storage Conditions

-20°C

Chemical Information

Gentamicin X2

Gentamicin X2 is an aminoglycoside. It is a conjugate base of a gentamicin X2 cation (4+).

CAS Number	36889-17-5
PubChem CID	15574862
IUPAC Name	(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol
Molecular Formula	C19H38N4O10
Molecular Weight	482.5
XLogP	-6.2
Topological Polar Surface Area	248
Hydrogen Bond Donor Count	10
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	6
Heavy Atom Count	33
Formal Charge	0
Complexity	652

SMILES

C[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)N)N)N)O

InChI

InChI=1S/C19H38N4O10/c1-19(29)5-30-18(13(28)16(19)23-2)33-15-7(21)3-6(20)14(12(15)27)32-17-9(22)11(26)10(25)8(4-24)31-17/h6-18,23-29H,3-5,20-22H2,1-2H3/t6-,7+,8+,9+,10+,11+,12-,13+,14+,15-,16+,17+,18+,19-/m0/s1

InChIKey

HFLKNINDVFJPQT-ZFAMMYHGSA-N

Chemical Structure

2D Structure

CAS: 36889-17-5

CID: 15574862

Formula: C19H38N4O10

MW: 482.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	482.5
XLogP3	-6.2
Hydrogen Bond Donor Count	10
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	6
Exact Mass	482.25879342
Monoisotopic Mass	482.25879342
Topological Polar Surface Area	248 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	652
Isotope Atom Count	0
Defined Atom Stereocenter Count	14
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Gentamicin X2 sulfate EvoPure®

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