3-Methylguanine; 7H-form, 7-Me
AlkaPlorer ID: AK041779
Synonym: 3,7-Dimethylguanine
IUPAC Name: 2-amino-3,7-dimethylpurin-6-one
Structure
SMILES: CN1C=NC2=C1C(O)=NC(=N)N2C
InChI: InChI=1S/C7H9N5O/c1-11-3-9-5-4(11)6(13)10-7(8)12(5)2/h3H,1-2H3,(H2,8,10,13)
InChIKey: KDXAUYFKVGLUHH-UHFFFAOYSA-N
Reference
Zyzzyanones B−D, Dipyrroloquinones from the Marine Sponge <i>Zyzzya </i><i>f</i><i>uliginosa</i>
PubChem CID: 10261674
CAS: 19143-67-0
LOTUS: LTS0214999
SuperNatural Ⅲ: SN0182973
NPASS: NPC143814
COCONUT: CNP0108793
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Zyzzya fuliginosa | Zyzzya | None | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
| Stereospermum acuminatissimum | Stereospermum | Bignoniaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 179.183
TPSA？: 79.72
MolLogP？: -0.5081300000000004
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Electrophorus electricus | Acetylcholinesterase | Inhibition | None | % | 10.1021/acs.jnatprod.0c00789 |
| Homo sapiens | HeLa | Inhibition | None | % | 10.1021/acs.jnatprod.0c00789 |
| None | Unchecked | Activity | None | None | 10.1021/acs.jnatprod.0c00789 |