Neoechinulin D
AlkaPlorer ID: AK047141
Synonym: '', 'Neoechinulin D'
IUPAC Name: (3R,6Z)-3-methyl-6-[[2-(2-methylbut-3-en-2-yl)-6-(3-methylbut-2-enyl)-1H-indol-3-yl]methylidene]piperazine-2,5-dione
Structure
SMILES: C=CC(C)(C)C1=C(/C=C2\N=C(O)[C@@H](C)N=C2O)C2=CC=C(CC=C(C)C)C=C2N1
InChI: InChI=1S/C24H29N3O2/c1-7-24(5,6)21-18(13-20-23(29)25-15(4)22(28)27-20)17-11-10-16(9-8-14(2)3)12-19(17)26-21/h7-8,10-13,15,26H,1,9H2,2-6H3,(H,25,29)(H,27,28)/b20-13-/t15-/m1/s1
InChIKey: YCCLECFRSYOPML-CTFRJJSNSA-N
Reference
Neoechinulin D, a new isoprenylated dehydrotryptophyl metabolite fromAspergillus amstelodami
PubChem CID: 162993229
LOTUS: LTS0176301
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus ruber | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 391.51500000000016
TPSA？: 80.97
MolLogP？: 5.796200000000005
Number of H-Donors: 3
Number of H-Acceptors: 2
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|