Dihydroxy Tilivalline
AlkaPlorer ID: AK412404
Synonym: None
IUPAC Name: 2,4-dihydroxy-6-(1H-indol-3-yl)-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Structure
SMILES: O=C1C2=CC(O)=CC(O)=C2NC(C2=CNC3=CC=CC=C23)C2CCCN12
InChI: InChI=1S/C20H19N3O3/c24-11-8-13-19(17(25)9-11)22-18(16-6-3-7-23(16)20(13)26)14-10-21-15-5-2-1-4-12(14)15/h1-2,4-5,8-10,16,18,21-22,24-25H,3,6-7H2
InChIKey: IMNRJRPWAJLJKF-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Xenorhabdus eapokensis | Xenorhabdus | Morganellaceae | Enterobacterales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 349.39000000000016
TPSA？: 88.58999999999999
MolLogP？: 3.350500000000001
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|