Antimycin A8b
AlkaPlorer ID: AK014049
Synonym: None
IUPAC Name: [(2R,3S,6S,7R,8R)-3-[(3-formamido-2-hydroxybenzoyl)amino]-2,6-dimethyl-8-(3-methylbutyl)-4,9-dioxo-1,5-dioxonan-7-yl] 3-methylbutanoate
Structure
SMILES: CC(C)CC[C@H]1C(=O)O[C@H](C)[C@H](N=C(O)C2=CC=CC(N=CO)=C2O)C(=O)O[C@@H](C)[C@@H]1OC(=O)CC(C)C
InChI: InChI=1S/C27H38N2O9/c1-14(2)10-11-19-24(38-21(31)12-15(3)4)17(6)37-27(35)22(16(5)36-26(19)34)29-25(33)18-8-7-9-20(23(18)32)28-13-30/h7-9,13-17,19,22,24,32H,10-12H2,1-6H3,(H,28,30)(H,29,33)/t16-,17+,19-,22+,24+/m1/s1
InChIKey: HLEQYMYKLIYQRC-GFRRLMGDSA-N
Reference
Antimycins, Inhibitors of ATP-Citrate Lyase, from a Streptomyces sp.
PubChem CID: 10098617
CAS: 197791-91-6
LOTUS: LTS0208282
{NPAtlas: NPA015349
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces sp. | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 534.6060000000002
TPSA？: 164.30999999999997
MolLogP？: 4.170500000000003
Number of H-Donors: 3
Number of H-Acceptors: 9
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Rattus norvegicus | ATP-citrate synthase | Ki | 4000.0 | nM | 10.1016/j.ejmech.2018.09.001 |