Texensine
AlkaPlorer ID: AK315690
Synonym: 2-(Dimethylamino)-N-[7-(1H-indol-3-ylmethyl)-3-(1-methylethyl)-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-4-methylpentanamide
IUPAC Name: 2-(dimethylamino)-N-[7-(1H-indol-3-ylmethyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-4-methylpentanamide
Structure
SMILES: CC(C)CC(C(=O)NC1C(=O)NC(CC2=CNC3=CC=CC=C23)C(=O)NC=CC2=CC=C(C=C2)OC1C(C)C)N(C)C
InChI: InChI=1S/C33H43N5O4/c1-20(2)17-28(38(5)6)32(40)37-29-30(21(3)4)42-24-13-11-22(12-14-24)15-16-34-31(39)27(36-33(29)41)18-23-19-35-26-10-8-7-9-25(23)26/h7-16,19-21,27-30,35H,17-18H2,1-6H3,(H,34,39)(H,36,41)(H,37,40)
InChIKey: KGVPIDDSFDHWJK-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Colubrina texensis | Colubrina | Rhamnaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 573.738
TPSA？: 115.56
MolLogP？: 3.860400000000003
Number of H-Donors: 4
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|