(6R,7R)-7-(4-carboxybutanamido)-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
AlkaPlorer ID: AK097433
Synonym: None
IUPAC Name: (6R,7R)-7-(4-carboxybutanoylamino)-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Structure
SMILES: O=C(O)CCCC(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(CO)CS[C@H]12
InChI: InChI=1S/C13H16N2O7S/c16-4-6-5-23-12-9(11(20)15(12)10(6)13(21)22)14-7(17)2-1-3-8(18)19/h9,12,16H,1-5H2,(H,14,17)(H,18,19)(H,21,22)/t9-,12-/m1/s1
InChIKey: GRQXHIBWEUNUHL-BXKDBHETSA-N
Source
Properties Information
Molecule Weight: 344.3450000000001
TPSA？: 147.73000000000002
MolLogP？: -0.1874999999999995
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 2
Activities Information
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