7-Methoxycephalosporin C; Deacetoxy
AlkaPlorer ID: AK305746
Synonym: 7-Methoxydeacetoxycephalosporin C, WS 3442D, Antibiotic WS 3442D
IUPAC Name: 7-[(5-amino-5-carboxypentanoyl)amino]-7-methoxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Structure
SMILES: COC1(N=C(O)CCCC(N)C(=O)O)C(=O)N2C(C(=O)O)=C(C)CSC21
InChI: InChI=1S/C15H21N3O7S/c1-7-6-26-14-15(25-2,13(24)18(14)10(7)12(22)23)17-9(19)5-3-4-8(16)11(20)21/h8,14H,3-6,16H2,1-2H3,(H,17,19)(H,20,21)(H,22,23)
InChIKey: DIIQQFMUDRGICJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces wadayamensis | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 387.41400000000016
TPSA？: 162.75
MolLogP？: 0.141500000000001
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|