Apiosporamide
AlkaPlorer ID: AK101717
Synonym: None
IUPAC Name: 3-[(1S,2S,4aR,6S,8aS)-2,6-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalene-1-carbonyl]-5-[(1R,2R,5R,6R)-2,5-dihydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]-4-hydroxy-1H-pyridin-2-one
Structure
SMILES: C[C@H]1CC[C@@H]2[C@@H](C(=O)C3=C(O)N=CC([C@]4(O)CC[C@@H](O)[C@H]5O[C@H]54)=C3O)[C@@H](C)C=C[C@H]2C1
InChI: InChI=1S/C24H31NO6/c1-11-3-6-14-13(9-11)5-4-12(2)17(14)20(28)18-19(27)15(10-25-23(18)29)24(30)8-7-16(26)21-22(24)31-21/h4-5,10-14,16-17,21-22,26,30H,3,6-9H2,1-2H3,(H2,25,27,29)/t11-,12-,13-,14-,16+,17-,21+,22+,24+/m0/s1
InChIKey: YQTIWISENUYMQD-UOIYJLCQSA-N
Reference
Apiosporamide, a New Antifungal Agent from the Coprophilous Fungus Apiospora montagnei
PubChem CID: 54712148
LOTUS: LTS0114717
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 429.5130000000001
TPSA？: 123.41
MolLogP？: 2.659700000000001
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Ascobolus | Ascobolus | Activity | 53.0 | % | 10.1021/np50114a012 |
| Bacillus subtilis | Bacillus subtilis | IZ | 32.0 | mm | 10.1021/np50114a012 |
| Candida albicans | Candida albicans | Activity | nan | None | 10.1021/np50114a012 |
| Staphylococcus aureus | Staphylococcus aureus | IZ | 21.0 | mm | 10.1021/np50114a012 |