Variolin B; 3',4',5',6'-Tetrahydro, N3'-Me
AlkaPlorer ID: AK317405
Synonym: N3'-Methyltetrahydrovariolin B
IUPAC Name: 13-amino-8-(2-amino-3-methyl-5,6-dihydro-4H-pyrimidin-4-yl)-1,3,12-triazatricyclo[7.4.0.02,7]trideca-2(7),4,8,10,12-pentaen-6-one
Structure
SMILES: CN1C(N)=NCCC1C1=C2C=CN=C(N)N2C2=NC=CC(O)=C12
InChI: InChI=1S/C15H17N7O/c1-21-8(2-5-19-14(21)16)11-9-3-6-20-15(17)22(9)13-12(11)10(23)4-7-18-13/h3-4,6-8H,2,5H2,1H3,(H2,16,19)(H2,17,20)(H,18,23)
InChIKey: HYNQVSLCZOFSKX-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Kirkpatrickia | Hymedesmiidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 311.34900000000005
TPSA？: 118.06
MolLogP？: 0.8615999999999999
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|