Oxepinamide F
AlkaPlorer ID: AK065545
Synonym: 'oxepinamide F'
IUPAC Name: (7S,10R)-7-benzyl-4-[(2R)-butan-2-yl]-10-methoxy-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1,3,11,13-tetraene-6,9-dione
Structure
SMILES: CC[C@@H](C)C1=C2N=C3OC=CC=C[C@]3(OC)C(=O)N2[C@@H](CC2=CC=CC=C2)C(O)=N1
InChI: InChI=1S/C23H25N3O4/c1-4-15(2)18-19-25-21-23(29-3,12-8-9-13-30-21)22(28)26(19)17(20(27)24-18)14-16-10-6-5-7-11-16/h5-13,15,17H,4,14H2,1-3H3,(H,24,27)/t15-,17+,23-/m1/s1
InChIKey: HFZOLZVOTSSKSM-LPXYKDPNSA-N
Reference
Oxepinamides: Novel Liver X Receptor Agonists from <i>Aspergillus puniceus</i>
PubChem CID: 51003508
LOTUS: LTS0172657
SuperNatural Ⅲ: SN0124577-04
NPASS: NPC125624
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus puniceus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
| Vespula vulgaris | Vespula | Vespidae | Hymenoptera | Insecta | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 407.47000000000014
TPSA？: 83.72
MolLogP？: 3.509000000000002
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 4