Amoxicillin

CAT: 1299-RM-A151200-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-A151200-04Size:100 mg

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CAS Number

26787-78-0

Molecular Formula

C16H19N3O5S

Molecular Weight

365.4

Product Name Synonym

(2S,5R,6R) -6- ((R) -2-amino-2- (4-hydroxyphenyl) acetamido) -3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Chemical Information

Amoxicillin

Amoxicillin is a penicillin in which the substituent at position 6 of the penam ring is a 2-amino-2-(4-hydroxyphenyl)acetamido group. It has a role as an antibacterial drug. It is a penicillin and a penicillin allergen. It is a conjugate acid of an amoxicillin(1-).

CAS Number	26787-78-0
PubChem CID	33613
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
Molecular Formula	C16H19N3O5S
Molecular Weight	365.4
XLogP	-2
Topological Polar Surface Area	158
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Heavy Atom Count	25
Formal Charge	0
Complexity	590

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

InChI

InChI=1S/C16H19N3O5S/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)/t9-,10-,11+,14-/m1/s1

InChIKey

LSQZJLSUYDQPKJ-NJBDSQKTSA-N

Chemical Structure

2D Structure

CAS: 26787-78-0

CID: 33613

Formula: C16H19N3O5S

MW: 365.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	365.4
XLogP3	-2
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	365.10454189
Monoisotopic Mass	365.10454189
Topological Polar Surface Area	158 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	590
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
AA182611-01	Amoxicillin

Amoxicillin

Chemical Information

Alternative Products

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