Actinidine; (S)-form, N-[2-(4-Hydroxyphenyl)ethyl]
AlkaPlorer ID: AK016242
Synonym: None
IUPAC Name: 4-[2-(4,7-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-2-yl)ethyl]phenol
Structure
SMILES: CC1=C[N+](CCC2=CC=C(O)C=C2)=CC2=C1CCC2C
InChI: InChI=1S/C18H21NO/c1-13-3-8-17-14(2)11-19(12-18(13)17)10-9-15-4-6-16(20)7-5-15/h4-7,11-13H,3,8-10H2,1-2H3/p+1
InChIKey: CKHCFVWFFIHGMT-UHFFFAOYSA-O
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Valeriana officinalis | Valeriana | Caprifoliaceae | Dipsacales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 268.38
TPSA？: 24.11
MolLogP？: 3.280520000000002
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|