Products for Research Use Only

Hygromycin A

CAT: 0013-GTR19279649-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19279649-02Size:5 mg
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Description
Hygromycin A, an antibiotic produced by Streptomyces, showed a relatively selective inhibitory activity against Borrelia burgdorferi. Hygromycin A can inhibit the synthesis of protein by bacterial ribosomes, which can be used to study the mechanism of Lyme disease and its antibacterial activity.
CAS Number
6379-56-2
Purity
99.53% (May vary between batches)
Smiles
O[C@H]1[C@]2 ([C@@] ([C@H] (O) [C@@H] (O) [C@H]1NC (/C (=C/C3=CC (O) =C (O[C@@H]4O[C@H] (C (C) =O) [C@@H] (O) [C@@H]4O) C=C3) /C) =O) (OCO2) [H]) [H]
Molecular Formula
C23H29NO12
Molecular Weight
511.48
Notes
For research use only.

Chemical Information

Hygromycin

Hygromycin A is a hydroxycinnamic acid. It has a role as a metabolite.

CAS Number6379-56-2
PubChem CID6433481
IUPAC Name(E)-N-[(3aS,4R,5R,6S,7R,7aR)-4,6,7-trihydroxy-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-5-yl]-3-[4-[(2S,3S,4S,5S)-5-acetyl-3,4-dihydroxyoxolan-2-yl]oxy-3-hydroxyphenyl]-2-methylprop-2-enamide
Molecular FormulaC23H29NO12
Molecular Weight511.5
XLogP-1.8
Topological Polar Surface Area204
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Heavy Atom Count36
Formal Charge0
Complexity853
SMILES
C/C(=C\C1=CC(=C(C=C1)O[C@H]2[C@H]([C@@H]([C@H](O2)C(=O)C)O)O)O)/C(=O)N[C@@H]3[C@@H]([C@H]([C@@H]4[C@H]([C@@H]3O)OCO4)O)O
InChI
InChI=1S/C23H29NO12/c1-8(22(32)24-13-14(27)16(29)21-20(15(13)28)33-7-34-21)5-10-3-4-12(11(26)6-10)35-23-18(31)17(30)19(36-23)9(2)25/h3-6,13-21,23,26-31H,7H2,1-2H3,(H,24,32)/b8-5+/t13-,14+,15-,16-,17+,18+,19-,20+,21-,23-/m1/s1
InChIKey
YQYJSBFKSSDGFO-IIHALWDASA-N
Chemical Structure
2D Structure
2D structure of Hygromycin
CAS: 6379-56-2
CID: 6433481
Formula: C23H29NO12
MW: 511.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight511.5
XLogP3-1.8
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Exact Mass511.16897536
Monoisotopic Mass511.16897536
Topological Polar Surface Area204 Ų
Heavy Atom Count36
Formal Charge0
Complexity853
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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