Antibiotic C 1778B; Ac

AlkaPlorer ID: AK288311

Synonym: Antibiotic C 1778A, 7-(Carboxybutanamido)cephalosporanic acid, C 1778A

IUPAC Name: 3-(acetyloxymethyl)-7-(4-carboxybutanoylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Structure

SMILES: CC(=O)OCC1=C(C(=O)O)N2C(=O)C(N=C(O)CCCC(=O)O)C2SC1

copy

InChI: InChI=1S/C15H18N2O8S/c1-7(18)25-5-8-6-26-14-11(13(22)17(14)12(8)15(23)24)16-9(19)3-2-4-10(20)21/h11,14H,2-6H2,1H3,(H,16,19)(H,20,21)(H,23,24)

copy

InChIKey: IXUSDMGLUJZNFO-UHFFFAOYSA-N

copy

Reference

PubChem CID: 3341657

CAS: 27920-90-7

COCONUT: CNP0306985.5

Source

Species Genus Family Order Class Phylum Kingdom Domain
None Cephalosporium None Hypocreales Sordariomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 386.3820000000002

TPSA: 153.79999999999998

MolLogP: 0.3832999999999999

Number of H-Donors: 3

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information