TMC-169
AlkaPlorer ID: AK025987
Synonym: '', 'TMC-169', 'TMC 169'
IUPAC Name: (1S,3E,5R,9E,11S,14S,15R,16S)-5-hydroxy-9,13,14-trimethyl-16-(2-methylpropyl)-17-azatricyclo[9.7.0.01,15]octadeca-3,9,12-triene-2,18-dione
Structure
SMILES: CC1=C[C@@H]2/C=C(\C)CCC[C@@H](O)/C=C/C(=O)[C@]23C(O)=N[C@@H](CC(C)C)[C@@H]3[C@@H]1C
InChI: InChI=1S/C24H35NO3/c1-14(2)11-20-22-17(5)16(4)13-18-12-15(3)7-6-8-19(26)9-10-21(27)24(18,22)23(28)25-20/h9-10,12-14,17-20,22,26H,6-8,11H2,1-5H3,(H,25,28)/b10-9+,15-12+/t17-,18+,19-,20+,22+,24-/m1/s1
InChIKey: PBMWGTZJDVBFGK-LPMZCCPSSA-N
Reference
TMC-169, a New Antibiotic of the Aspochalasin Group Produced by Aspergillus flavipes.
PubChem CID: 162876342
LOTUS: LTS0271229
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus flavipes | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 385.5480000000001
TPSA？: 69.89
MolLogP？: 4.802400000000004
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|