Antibiotic AB 4063B; 1'',2''-Epoxide
AlkaPlorer ID: AK288254
Synonym: Antibiotic AB 4063A, AB 4063A
IUPAC Name: 3-[[2-(2,3-dimethyloxiran-2-yl)-3,6,8-trimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]-1-methyl-5-propan-2-ylpyrrolidine-2,4-dione
Structure
SMILES: CC1=CC2CC(C)CC(C)C2C(C(O)=C2C(=O)C(C(C)C)N(C)C2=O)C1C1(C)OC1C
InChI: InChI=1S/C26H39NO4/c1-12(2)22-24(29)20(25(30)27(22)8)23(28)19-18-14(4)9-13(3)10-17(18)11-15(5)21(19)26(7)16(6)31-26/h11-14,16-19,21-22,28H,9-10H2,1-8H3
InChIKey: KMQIUWBTAGYGOY-UHFFFAOYSA-N
Reference
CAS: 160041-32-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phoma sp. | Phoma | Didymellaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 429.6010000000002
TPSA？: 70.14
MolLogP？: 4.532300000000004
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|