Chitinovorin C
AlkaPlorer ID: AK014663
Synonym: None
IUPAC Name: (6R,7R)-7-[[(5R)-5-amino-5-carboxypentanoyl]amino]-7-formamido-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Structure
SMILES: N[C@H](CCCC(=O)N[C@]1(NC=O)C(=O)N2C(C(=O)O)=C(CO)CS[C@@H]21)C(=O)O
InChI: InChI=1S/C15H20N4O8S/c16-8(11(23)24)2-1-3-9(22)18-15(17-6-21)13(27)19-10(12(25)26)7(4-20)5-28-14(15)19/h6,8,14,20H,1-5,16H2,(H,17,21)(H,18,22)(H,23,24)(H,25,26)/t8-,14-,15-/m1/s1
InChIKey: RQPIYCBIFMMJEJ-KBOAJJQZSA-N
Reference
Chitinovorins A, B and C, novel .BETA.-lactam antibiotics of bacterial origin.
PubChem CID: 125271
CAS: 95230-98-1
LOTUS: LTS0063933
SuperNatural Ⅲ: SN0332579-01
{NPAtlas: NPA021385
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Flavobacteriaceae | Flavobacteriales | Flavobacteriia | Bacteroidota | None | Bacteria |
Properties Information
Molecule Weight: 416.41200000000015
TPSA？: 199.36
MolLogP？: -2.6267999999999967
Number of H-Donors: 6
Number of H-Acceptors: 8
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|