Cephabacin F; Cephabacin F4
AlkaPlorer ID: AK291878
Synonym: Antibiotic TAN 592A, TAN 592A
IUPAC Name: 7-[(5-amino-5-carboxypentanoyl)amino]-3-[[4-[(2-amino-3-hydroxypropanoyl)amino]-7-(diaminomethylideneamino)-3-hydroxyheptanoyl]oxymethyl]-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Structure
SMILES: N=C(N)NCCCC(N=C(O)C(N)CO)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/C26H41N9O12S/c27-13(21(42)43)3-1-5-17(39)34-26(32-11-37)23(46)35-19(22(44)45)12(10-48-24(26)35)9-47-18(40)7-16(38)15(4-2-6-31-25(29)30)33-20(41)14(28)8-36/h11,13-16,24,36,38H,1-10,27-28H2,(H,32,37)(H,33,41)(H,34,39)(H,42,43)(H,44,45)(H4,29,30,31)
InChIKey: LXHQETNKPVPYNA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Xanthomonas | Xanthomonadaceae | Xanthomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 703.7320000000001
TPSA？: 373.38
MolLogP？: -2.73632999999999
Number of H-Donors: 12
Number of H-Acceptors: 14
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|