Cephalosporin C
AlkaPlorer ID: AK000226
Synonym: 'cephalosporin c', 'Cephalosporin C'
IUPAC Name: (6R,7S)-3-(acetyloxymethyl)-7-[[(5S)-5-amino-5-carboxypentanoyl]amino]-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@H](NC(=O)CCC[C@H](N)C(=O)O)[C@H]2SC1
InChI: InChI=1S/C16H21N3O8S/c1-7(20)27-5-8-6-28-14-11(13(22)19(14)12(8)16(25)26)18-10(21)4-2-3-9(17)15(23)24/h9,11,14H,2-6,17H2,1H3,(H,18,21)(H,23,24)(H,25,26)/t9-,11-,14+/m0/s1
InChIKey: HOKIDJSKDBPKTQ-NURSFMCSSA-N
Reference
<b>A New Natural Penicillin from</b> <i>Penicillium Chrysogenum</i>
PubChem CID: 92209764
LOTUS: LTS0106159
SuperNatural Ⅲ: SN0131134-05
NPASS: NPC165659
Source
Properties Information
Molecule Weight: 415.4240000000002
TPSA？: 176.32999999999998
MolLogP？: -1.129699999999996
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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