Cephabacin F; Cephabacin F4, 28-Deoxy, N27-L-alanyl
AlkaPlorer ID: AK291880
Synonym: Cephabacin F2, Chitinovorin B, TAN 547B, Antibiotic TAN 547B
IUPAC Name: 7-[(5-amino-5-carboxypentanoyl)amino]-3-[[4-[2-(2-aminopropanoylamino)propanoylamino]-7-(diaminomethylideneamino)-3-hydroxyheptanoyl]oxymethyl]-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Structure
SMILES: CC(N)C(O)=NC(C)C(O)=NC(CCCNC(=N)N)C(O)CC(=O)OCC1=C(C(=O)O)N2C(=O)C(N=CO)(N=C(O)CCCC(N)C(=O)O)C2SC1
InChI: InChI=1S/C29H46N10O12S/c1-13(30)22(44)36-14(2)23(45)37-17(6-4-8-34-28(32)33)18(41)9-20(43)51-10-15-11-52-27-29(35-12-40,26(50)39(27)21(15)25(48)49)38-19(42)7-3-5-16(31)24(46)47/h12-14,16-18,27,41H,3-11,30-31H2,1-2H3,(H,35,40)(H,36,44)(H,37,45)(H,38,42)(H,46,47)(H,48,49)(H4,32,33,34)
InChIKey: GYGJEMVAHZKULL-UHFFFAOYSA-N
Reference
Chitinovorins A, B and C, novel .BETA.-lactam antibiotics of bacterial origin.
PubChem CID: 125725
CAS: 95722-76-2
LOTUS: LTS0138259
COCONUT: CNP0292354.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lysobacter lactamgenus | Lysobacter | Xanthomonadaceae | Xanthomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
| None | Flavobacterium | Flavobacteriaceae | Flavobacteriales | Flavobacteriia | Bacteroidota | None | Bacteria |
Properties Information
Molecule Weight: 758.8120000000001
TPSA？: 385.74000000000007
MolLogP？: -1.363729999999994
Number of H-Donors: 12
Number of H-Acceptors: 14
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|