Lankacidin C
AlkaPlorer ID: AK002539
Synonym: None
IUPAC Name: N-[(1S,2R,3E,5E,7S,9E,11E,13S,15R,19R)-7,13-dihydroxy-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo[13.2.2]nonadeca-3,5,9,11-tetraen-2-yl]-2-oxopropanamide
Structure
SMILES: CC(=O)C(=O)N[C@@H]1/C=C(C)/C=C/[C@@H](O)C/C=C(C)/C=C/[C@@H](O)C[C@H]2OC(=O)[C@]1(C)C(=O)[C@@H]2C
InChI: InChI=1S/C25H33NO7/c1-14-6-9-18(28)10-8-15(2)12-21(26-23(31)17(4)27)25(5)22(30)16(3)20(33-24(25)32)13-19(29)11-7-14/h6-8,10-12,16,18-21,28-29H,9,13H2,1-5H3,(H,26,31)/b10-8+,11-7+,14-6+,15-12+/t16-,18+,19-,20-,21-,25+/m1/s1
InChIKey: ATDILMLBOZKFGI-JUTMVFGESA-N
Reference
STUDIES ON LANKACIDIN-GROUP (T-2636) ANTIBIOTICS
PubChem CID: 6440871
LOTUS: LTS0226163
SuperNatural Ⅲ: SN0014736-10
{NPAtlas: NPA004098
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces griseofuscus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 459.5390000000002
TPSA？: 130.0
MolLogP？: 1.7176999999999991
Number of H-Donors: 3
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A549 | IC50 | 100000.0 | nM | 10.1016/j.bmc.2021.116551 |
| Homo sapiens | HeLa | IC50 | 23300.0 | nM | 10.1016/j.bmc.2021.116551 |
| Homo sapiens | MCF7 | IC50 | 100000.0 | nM | 10.1016/j.bmc.2021.116551 |
| Micrococcus luteus | Micrococcus luteus | MIC | 6200.0 | nM | 10.1016/j.bmc.2021.116551 |