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Amoxicillin trihydrate, BP, EP grade

CAT: 0862-GA7845-25gSize: 25 gDry Ice: NoHazardous: No
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CAT#:0862-GA7845-25gSize:25 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
61336-70-7
EC Number
243-003-8
MDL Number
MFCD00056860 (anhy.)
HS Code
29411000
Purity
95.00%
Molecular Formula
C16H19N3O5S · 3H2O
Molecular Weight
365.40 (anhydrous)
Storage Conditions
+4°C
Hazardous Class
Not hazardous

Chemical Information

Amoxicillin Trihydrate

Amoxicillin trihydrate is a hydrate that is the trihydrate form of amoxicillin; a semisynthetic antibiotic, used either alone or in combination with potassium clavulanate (under the trade name Augmentin) for treatment of a variety of bacterial infections. It has a role as an antimicrobial agent and an antibacterial drug. It contains an amoxicillin.

CAS Number61336-70-7
PubChem CID62883
IUPAC Name(2S,5R,6R)-6-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;trihydrate
Molecular FormulaC16H25N3O8S
Molecular Weight419.5
Topological Polar Surface Area161
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity590
SMILES
CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)O)C.O.O.O
InChI
InChI=1S/C16H19N3O5S.3H2O/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7;;;/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24);3*1H2/t9-,10-,11+,14-;;;/m1.../s1
InChIKey
MQXQVCLAUDMCEF-CWLIKTDRSA-N
Chemical Structure
2D Structure
2D structure of Amoxicillin Trihydrate
CAS: 61336-70-7
CID: 62883
Formula: C16H25N3O8S
MW: 419.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight419.5
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass419.13623594
Monoisotopic Mass419.13623594
Topological Polar Surface Area161 Ų
Heavy Atom Count28
Formal Charge0
Complexity590
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count4
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
A004-25GAmoxicillin Trihydrate
HY-B0467B-01Amoxicillin (trihydrate)

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