Cycloaspeptide A; 4'-Deoxy
AlkaPlorer ID: AK293491
Synonym: Cycloaspeptide E
IUPAC Name: 4,10-dibenzyl-5,11,13-trimethyl-7-(2-methylpropyl)-2,5,8,11,14-pentazabicyclo[14.4.0]icosa-1(20),16,18-triene-3,6,9,12,15-pentone
Structure
SMILES: CC(C)CC1N=C(O)C(CC2=CC=CC=C2)N(C)C(=O)C(C)N=C(O)C2=CC=CC=C2N=C(O)C(CC2=CC=CC=C2)N(C)C1=O
InChI: InChI=1S/C36H43N5O5/c1-23(2)20-29-36(46)41(5)31(22-26-16-10-7-11-17-26)33(43)38-28-19-13-12-18-27(28)32(42)37-24(3)35(45)40(4)30(34(44)39-29)21-25-14-8-6-9-15-25/h6-19,23-24,29-31H,20-22H2,1-5H3,(H,37,42)(H,38,43)(H,39,44)
InChIKey: RHOUSNKWOXJDCO-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
| None | Trichothecium | None | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
| None | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 625.7700000000002
TPSA？: 138.39
MolLogP？: 5.4919000000000056
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|