2-amino-6,12-bis(6-bromo-1H-indol-3-yl)-9-imino-1,8,10-trimethyl-1,3,8,10-tetraazadispiro[4.1.4?.1?]dodec-2-ene-4,11-dione
AlkaPlorer ID: AK325320
Synonym: None
IUPAC Name: (6R,12R)-6,12-bis(6-bromo-1H-indol-3-yl)-3,10-diimino-4,9,11-trimethyl-2,4,9,11-tetrazadispiro[4.1.47.15]dodecane-1,8-dione
Structure
SMILES: CN1C(=N)N(C)[C@]2(C1=O)[C@H](C1=CNC3=CC(Br)=CC=C13)[C@]1(C(O)=NC(=N)N1C)[C@H]2C1=CNC2=CC(Br)=CC=C12
InChI: InChI=1S/C27H24Br2N8O2/c1-35-23(39)27(37(3)25(35)31)20(16-10-32-18-8-12(28)4-6-14(16)18)26(22(38)34-24(30)36(26)2)21(27)17-11-33-19-9-13(29)5-7-15(17)19/h4-11,20-21,31-33H,1-3H3,(H2,30,34,38)/t20-,21-,26-,27-/m1/s1
InChIKey: CKVBWFBLCKTQEC-RLKINFHOSA-N
Reference
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ageratina altissima | Ageratina | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Stemona kerrii | Stemona | Stemonaceae | Pandanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 652.3510000000001
TPSA？: 138.66
MolLogP？: 4.708040000000002
Number of H-Donors: 5
Number of H-Acceptors: 3
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|