Pseudozoanthoxanthin A; 1-(6-Carboxy-2E-hexenyl), N2,N8N8-tri-Me
AlkaPlorer ID: AK311562
Synonym: Pseudozoanthoxanthin IV
IUPAC Name: (E)-7-[12-(dimethylamino)-7-methyl-4-(methylamino)-3,5,11,13-tetrazatricyclo[8.3.0.02,6]trideca-1,4,6,8,10,12-hexaen-3-yl]hept-5-enoic acid
Structure
SMILES: CNC1=NC2=C(C)C=CC3=NC(N(C)C)=NC3=C2N1C/C=C/CCCC(=O)O
InChI: InChI=1S/C20H26N6O2/c1-13-10-11-14-17(24-20(22-14)25(3)4)18-16(13)23-19(21-2)26(18)12-8-6-5-7-9-15(27)28/h6,8,10-11H,5,7,9,12H2,1-4H3,(H,21,23)(H,27,28)/b8-6+
InChIKey: PMDGXSAZAHEGNW-SOFGYWHQSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Echinogorgia | Plexauridae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 382.4680000000002
TPSA？: 96.17
MolLogP？: 3.1583200000000016
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|