Caracurine V; Nb,Nb'-Dioxide
AlkaPlorer ID: AK291625
Synonym: Caracurine V di-N-oxide
IUPAC Name: 15,35-dioxido-10,30-dioxa-8,28-diaza-15,35-diazoniatridecacyclo[33.5.2.215,21.01,36.02,7.08,40.09,19.013,18.016,21.020,28.022,27.029,39.033,38]tetratetraconta-2,4,6,12,22,24,26,32-octaene
Structure
SMILES: [O-][N+]12CCC34C5=CC=CC=C5N5C6OCC=C7C[N+]8([O-])CCC9%10C%11=CC=CC=C%11N(C%11OCC=C(C1)C(CC32)C%11C54)C9C6C7CC%108
InChI: InChI=1S/C38H40N4O4/c43-41-13-11-37-25-5-1-3-7-27(25)39-33(37)31-23(17-29(37)41)21(19-41)10-16-46-36(31)40-28-8-4-2-6-26(28)38-12-14-42(44)20-22-9-15-45-35(39)32(34(38)40)24(22)18-30(38)42/h1-10,23-24,29-36H,11-20H2
InChIKey: RLBPQSFUMJXQQH-UHFFFAOYSA-N
Reference
CAS: 66067-02-5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Strychnos toxifera | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 616.7620000000004
TPSA？: 71.06
MolLogP？: 4.291800000000004
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 13
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|