Adenine; 9H-form, N9-[1-(3,4-Dihydroxyphenyl)ethyl]
AlkaPlorer ID: AK282854
Synonym: 6-Amino-9-[1-(3,4-dihydroxyphenyl)ethyl]purine, 9-[1-(3,4-Dihydroxyphenyl)ethyl]adenine
IUPAC Name: 4-[1-(6-aminopurin-9-yl)ethyl]benzene-1,2-diol
Structure
SMILES: CC(C1=CC=C(O)C(O)=C1)N1C=NC2=C(N)N=CN=C21
InChI: InChI=1S/C13H13N5O2/c1-7(8-2-3-9(19)10(20)4-8)18-6-17-11-12(14)15-5-16-13(11)18/h2-7,19-20H,1H3,(H2,14,15,16)
InChIKey: KYMVQMSXUHNDIW-UHFFFAOYSA-N
Reference
Two New Constituents from Artemisia capillaris Thunb.
PubChem CID: 86765223
LOTUS: LTS0252930
COCONUT: CNP0270115.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Artemisia capillaris | Artemisia | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 271.28000000000003
TPSA？: 110.08
MolLogP？: 1.4289999999999996
Number of H-Donors: 3
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|