Brevicompanine H
AlkaPlorer ID: AK043414
Synonym: None
IUPAC Name: (1R,4S,7S,9R)-9-(2-methylbut-3-en-2-yl)-16-propanoyl-4-propan-2-yl-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](C(C)C)C(=O)N3[C@@H]1N(C(=O)CC)C1=CC=CC=C12
InChI: InChI=1S/C24H31N3O3/c1-7-18(28)26-16-12-10-9-11-15(16)24(23(5,6)8-2)13-17-20(29)25-19(14(3)4)21(30)27(17)22(24)26/h8-12,14,17,19,22H,2,7,13H2,1,3-6H3,(H,25,29)/t17-,19-,22-,24+/m0/s1
InChIKey: BBDIFTVRYQWOJP-UNBWHIKDSA-N
Reference
Diketopiperazine Alkaloids from a Deep Ocean Sediment Derived Fungus Penicillium sp.
PubChem CID: 44203548
LOTUS: LTS0236451
SuperNatural Ⅲ: SN0020828-01
{NPAtlas: NPA002353
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Penicillium sp. | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 409.5300000000002
TPSA？: 73.21000000000001
MolLogP？: 3.8149000000000033
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|