Welwitindolinone B isothiocyanate; 13,14-Didehydro, N-Me
AlkaPlorer ID: AK317882
Synonym: Welwistatin, N-Methylwelwitindolinone C isothiocyanate
IUPAC Name: 4-chloro-3-ethenyl-2-isothiocyanato-3,7,7,10-tetramethyl-10-azatetracyclo[6.6.1.12,6.011,15]hexadeca-1(15),4,11,13-tetraene-9,16-dione
Structure
SMILES: C=CC1(C)C(Cl)=CC2C(=O)C1(N=C=S)C1=CC=CC3=C1C(C(=O)N3C)C2(C)C
InChI: InChI=1S/C22H21ClN2O2S/c1-6-21(4)15(23)10-13-18(26)22(21,24-11-28)12-8-7-9-14-16(12)17(20(13,2)3)19(27)25(14)5/h6-10,13,17H,1H2,2-5H3
InChIKey: ULCGNHFUBLOLRR-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Major | Dolichopodidae | Diptera | Insecta | Arthropoda | Metazoa | Eukaryota |
| Westiella intricata | Westiella | Hapalosiphonaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 412.9420000000002
TPSA？: 49.74
MolLogP？: 4.598400000000004
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|