Antibiotic SQ 28516
AlkaPlorer ID: AK288698
Synonym: SQ 28516
IUPAC Name: 7-[(5-acetamido-5-carboxypentanoyl)amino]-3-[[4-[2-[2-(2-acetamidopropanoylamino)propanoylamino]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(O)=NC(C)C(O)=NC(C)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(C)O)C(=O)O)C2SC1
InChI: InChI=1S/C36H55N11O15S/c1-16(41-19(4)49)28(54)42-17(2)29(55)43-18(3)30(56)45-22(9-7-11-39-35(37)38)24(51)12-26(53)62-13-21-14-63-34-36(40-15-48,33(61)47(34)27(21)32(59)60)46-25(52)10-6-8-23(31(57)58)44-20(5)50/h15-18,22-24,34,51H,6-14H2,1-5H3,(H,40,48)(H,41,49)(H,42,54)(H,43,55)(H,44,50)(H,45,56)(H,46,52)(H,57,58)(H,59,60)(H4,37,38,39)
InChIKey: SXYVIJFRSHABDG-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Flavobacterium sp. | Flavobacterium | Flavobacteriaceae | Flavobacteriales | Flavobacteriia | Bacteroidota | None | Bacteria |
Properties Information
Molecule Weight: 913.965
TPSA？: 431.4700000000001
MolLogP？: 1.0166700000000106
Number of H-Donors: 13
Number of H-Acceptors: 15
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|