Trienomycin E
AlkaPlorer ID: AK010331
Synonym: '', 'Trienomycin E'
IUPAC Name: [(5R,6Z,8Z,10Z,13S,14S,15R,16Z)-15,22-dihydroxy-5-methoxy-14,16-dimethyl-3-oxo-2-azabicyclo[18.3.1]tetracosa-1(23),6,8,10,16,20(24),21-heptaen-13-yl] (2R)-2-(4-methylpentanoylamino)propanoate
Structure
SMILES: CO[C@H]1/C=C\C=C/C=C\C[C@H](OC(=O)[C@@H](C)N=C(O)CCC(C)C)[C@@H](C)[C@@H](O)/C(C)=C\CCC2=CC(=CC(O)=C2)N=C(O)C1
InChI: InChI=1S/C35H50N2O7/c1-23(2)17-18-32(39)36-26(5)35(42)44-31-16-11-9-7-8-10-15-30(43-6)22-33(40)37-28-19-27(20-29(38)21-28)14-12-13-24(3)34(41)25(31)4/h7-11,13,15,19-21,23,25-26,30-31,34,38,41H,12,14,16-18,22H2,1-6H3,(H,36,39)(H,37,40)/b8-7-,11-9-,15-10-,24-13-/t25-,26-,30+,31+,34+/m1/s1
InChIKey: JJBUXIPSVLPJSA-HWRDDRQASA-N
Reference
New ansamycin analogues from the mutant strain of Streptomyces seoulensis
PubChem CID: 6449818
CAS: 107140-29-4
LOTUS: LTS0090710
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces cacaoi | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 610.7920000000003
TPSA？: 141.17000000000002
MolLogP？: 7.026500000000009
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|