Aspochalasin I; 19ξ,20-Dihydro, 17-ketone
AlkaPlorer ID: AK289592
Synonym: Aspochalasin A1
IUPAC Name: 6-hydroxy-10,14,15-trimethyl-17-(2-methylpropyl)-2-oxa-18-azatricyclo[10.7.0.01,16]nonadeca-10,13-diene-3,7,19-trione
Structure
SMILES: CC1=CC2C=C(C)C(C)C3C(CC(C)C)NC(=O)C23OC(=O)CCC(O)C(=O)CC1
InChI: InChI=1S/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h11-13,16-18,20,22,27H,6-10H2,1-5H3,(H,25,29)
InChIKey: MPMJLHQXZNLSCP-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus elegans | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 417.54600000000033
TPSA？: 92.7
MolLogP？: 3.091600000000001
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|