None
AlkaPlorer ID: AK324344
Synonym: None
IUPAC Name: None
Structure
SMILES: CO[C@H]1[C@H](O[C@H]([C@H]2O[C@@H](N3C=CC(O)=NC3=O)[C@H](O)[C@@H]2O)[C@H](NCCCN=C(O)[C@@H](N=C(O)[C@@H](NC(O)=N[C@H](C(=O)O)C(C)C)[C@@H]2CCNC(=N)N2)[C@@H](OC(=O)CCCCCCCCCCCCC(C)C)C(C)C)C(=O)O)O[C@H](CN)[C@H]1O
InChI: InChI=1S/C54H93N11O18/c1-28(2)19-16-14-12-10-8-9-11-13-15-17-20-34(67)81-42(30(5)6)37(62-47(72)36(31-21-25-59-52(56)60-31)64-53(77)63-35(29(3)4)49(73)74)46(71)58-24-18-23-57-38(50(75)76)43(83-51-45(79-7)39(68)32(27-55)80-51)44-40(69)41(70)48(82-44)65-26-22-33(66)61-54(65)78/h22,26,28-32,35-45,48,51,57,68-70H,8-21,23-25,27,55H2,1-7H3,(H,58,71)(H,62,72)(H,73,74)(H,75,76)(H3,56,59,60)(H,61,66,78)(H2,63,64,77)/t31-,32+,35-,36-,37-,38-,39+,40-,41+,42-,43-,44-,45+,48+,51-/m0/s1
InChIKey: INQKTUSDVJJZDY-BBHJCMPKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces sp. NRRL 30471 | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1184.3969999999993
TPSA？: 449.39
MolLogP？: 1.499969999999997
Number of H-Donors: 15
Number of H-Acceptors: 21
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Aquifex aeolicus (strain VF5) | Phospho-N-acetylmuramoyl-pentapeptide-transferase | IC50 | 0.0068 | nM | 10.1021/acs.jnatprod.7b01054 |
| Escherichia coli | Escherichia coli | MIC | 4.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b01054 |
| Escherichia coli | Escherichia coli | MIC | 64.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b01054 |
| Staphylococcus aureus | Phospho-N-acetylmuramoyl-pentapeptide-transferase | IC50 | 0.004 | nM | 10.1021/acs.jnatprod.7b01054 |
| Staphylococcus aureus | Staphylococcus aureus | MIC | 2.0 | ug.mL-1 | 10.1021/acs.jnatprod.7b01054 |