penicillin g

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

CAS: 61-33-6

Molecular Formula	`C16H18N2O4S`
Molecular Weight	334.4 g/mol
LogP	1.8
Topological Polar Surface Area	112.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	334.09872
Heavy Atoms	23
Complexity	530.0

Chemical Identifiers

CAS Number	61-33-6
SMILES	`CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C`
InChIKey	`JGSARLDLIJGVTE-MBNYWOFBSA-N`

📖 Product Overview

penicillin g (CAS: 61-33-6) is a chemical compound with molecular formula C16H18N2O4S and molecular weight 334.4 g/mol. Its IUPAC systematic name is (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid. LogP 1.8 Topological Polar Surface Area 112.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 334.09872 Heavy Atoms 23 Complexity 530.0 InChI Key: JGSARLDLIJGVTE-MBNYWOFBSA-N. SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C.

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