Brevicompanine F
AlkaPlorer ID: AK074756
Synonym: None
IUPAC Name: (1R,4S,7S,9R)-16-butanoyl-9-(2-methylbut-3-en-2-yl)-4-(2-methylpropyl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
Structure
SMILES: C=CC(C)(C)[C@@]12C[C@H]3C(O)=N[C@@H](CC(C)C)C(=O)N3[C@@H]1N(C(=O)CCC)C1=CC=CC=C12
InChI: InChI=1S/C26H35N3O3/c1-7-11-21(30)28-19-13-10-9-12-17(19)26(25(5,6)8-2)15-20-22(31)27-18(14-16(3)4)23(32)29(20)24(26)28/h8-10,12-13,16,18,20,24H,2,7,11,14-15H2,1,3-6H3,(H,27,31)/t18-,20-,24-,26+/m0/s1
InChIKey: JIILGMDGBROFNV-IHJBEOSKSA-N
Reference
Diketopiperazine Alkaloids from a Deep Ocean Sediment Derived Fungus Penicillium sp.
PubChem CID: 44203524
LOTUS: LTS0168722
SuperNatural Ⅲ: SN0166285-01
{NPAtlas: NPA016193
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Penicillium sp. | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 437.5840000000002
TPSA？: 73.21000000000001
MolLogP？: 4.595100000000004
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|