N-prenyl-cyclo-L-tryptophyl-L-proline
AlkaPlorer ID: AK057049
Synonym: None
IUPAC Name: (3S,8aS)-3-[[1-(3-methylbut-2-enyl)indol-3-yl]methyl]-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Structure
SMILES: CC(C)=CCN1C=C(C[C@@H]2N=C(O)[C@@H]3CCCN3C2=O)C2=CC=CC=C21
InChI: InChI=1S/C21H25N3O2/c1-14(2)9-11-23-13-15(16-6-3-4-7-18(16)23)12-17-21(26)24-10-5-8-19(24)20(25)22-17/h3-4,6-7,9,13,17,19H,5,8,10-12H2,1-2H3,(H,22,25)/t17-,19-/m0/s1
InChIKey: UHDXIZKDEGWFRD-HKUYNNGSSA-N
Reference
PubChem CID: 102011067
LOTUS: LTS0044210
SuperNatural Ⅲ: SN0370353-01
{NPAtlas: NPA016269
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus fumigatus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 351.4500000000001
TPSA？: 57.83
MolLogP？: 3.479700000000002
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|