Sch 54796
AlkaPlorer ID: AK035861
Synonym: None
IUPAC Name: (3S,6R)-3-[[4-(3-methylbut-2-enoxy)phenyl]methyl]-3,6-bis(methylsulfanyl)piperazine-2,5-dione
Structure
SMILES: CS[C@H]1N=C(O)[C@](CC2=CC=C(OCC=C(C)C)C=C2)(SC)N=C1O
InChI: InChI=1S/C18H24N2O3S2/c1-12(2)9-10-23-14-7-5-13(6-8-14)11-18(25-4)17(22)19-16(24-3)15(21)20-18/h5-9,16H,10-11H2,1-4H3,(H,19,22)(H,20,21)/t16-,18+/m1/s1
InChIKey: OUPACRHVFRGERT-AEFFLSMTSA-N
Reference
Two novel diketopiperazines isolated from the fungus Tolypocladium sp.
PubChem CID: 10339764
LOTUS: LTS0138578
SuperNatural Ⅲ: SN0275651-02
{NPAtlas: NPA007963
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tolypocladium sp. | Tolypocladium | Ophiocordycipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 380.535
TPSA？: 74.41000000000001
MolLogP？: 4.249100000000003
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|