AMOXICILLIN, L-

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Keyword(s): Human Neurotoxin
Molecule Category Free-form
UNII 623M8I9SZN
EPA CompTox DTXSID30181396

Structure

InChI Key LSQZJLSUYDQPKJ-BBGACYKPSA-N
Smiles CC1(C)S[C@@H]2[C@H](NC(=O)[C@@H](N)C3=CC=C(O)C=C3)C(=O)N2[C@H]1C(O)=O
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+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H19N3O5S
Molecular Weight 365.1
AlogP 0.86
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 4.0
Polar Surface Area 136.45
Heavy Atoms 25.0

Cross References

Resources Reference
CAS NUMBER 26889-93-0
NORMAN SUSDAT
FDA SRS 623M8I9SZN
CONTENTS