Cyclo(alanyltryptophyl); (3S,6R)-form, 3,6-Bis(methylthio), N1-Me
AlkaPlorer ID: AK293458
Synonym: 3-(1H-Indol-3-ylmethyl)-1,6-dimethyl-3,6-bis(methylthio)-2,5-piperazinedione, Lasiodipline E
IUPAC Name: 3-(1H-indol-3-ylmethyl)-1,6-dimethyl-3,6-bis(methylsulfanyl)piperazine-2,5-dione
Structure
SMILES: CSC1(CC2=CNC3=CC=CC=C23)N=C(O)C(C)(SC)N(C)C1=O
InChI: InChI=1S/C17H21N3O2S2/c1-16(23-3)14(21)19-17(24-4,15(22)20(16)2)9-11-10-18-13-8-6-5-7-12(11)13/h5-8,10,18H,9H2,1-4H3,(H,19,21)
InChIKey: MUVHKGMQAIWHRP-UHFFFAOYSA-N
Reference
An antibacterial metabolite from Lasiodiplodia pseudotheobromae F2
PubChem CID: 163065409
LOTUS: LTS0077351
COCONUT: CNP0356578.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lasiodiplodia pseudotheobromae | Lasiodiplodia | Botryosphaeriaceae | Botryosphaeriales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 363.50800000000015
TPSA？: 68.69
MolLogP？: 3.277400000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|