Antibiotic C4; Deoxy
AlkaPlorer ID: AK288306
Synonym: Antibiotic C6
IUPAC Name: 7-[(5-carboxy-5-oxopentanoyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Structure
SMILES: CC1=C(C(=O)O)N2C(=O)C(N=C(O)CCCC(=O)C(=O)O)C2SC1
InChI: InChI=1S/C14H16N2O7S/c1-6-5-24-12-9(11(19)16(12)10(6)14(22)23)15-8(18)4-2-3-7(17)13(20)21/h9,12H,2-5H2,1H3,(H,15,18)(H,20,21)(H,22,23)
InChIKey: KSTHTLRRLTVOQR-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Cephalosporium | None | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 356.35600000000005
TPSA？: 144.57
MolLogP？: 0.4091999999999999
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|