Parazoanthoxanthin A; 3,N6,N6-Tri-Me
AlkaPlorer ID: AK086788
Synonym: Zoanthoxanthin
IUPAC Name: 5-N,5-N,2,13-tetramethyl-4,6,11,13-tetrazatricyclo[8.3.0.03,7]trideca-1(10),2,4,6,8,11-hexaene-5,12-diamine
Structure
SMILES: CC1=C2N=C(N(C)C)N=C2C=CC2=C1N(C)C(N)=N2
InChI: InChI=1S/C13H16N6/c1-7-10-8(16-13(17-10)18(2)3)5-6-9-11(7)19(4)12(14)15-9/h5-6H,1-4H3,(H2,14,15)
InChIKey: CMSKFFAQLCKXAR-UHFFFAOYSA-N
Reference
Zoanthoxanthin, a natural 1,3,5,7-tetrazacyclopent-azulene from Parazoanthus axinellae
PubChem CID: 620682
LOTUS: LTS0077262
SuperNatural Ⅲ: SN0050008
COCONUT: CNP0184735
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Parazoanthus axinellae | Parazoanthus | Parazoanthidae | Zoantharia | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 256.313
TPSA？: 72.86
MolLogP？: 1.4247199999999998
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|