Crispine E
AlkaPlorer ID: AK293221
Synonym: None
IUPAC Name: 2-[3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)propyl]guanidine
Structure
SMILES: COC1=CC2=C(C=C1OC)C(CCCNC(=N)N)NCC2
InChI: InChI=1S/C15H24N4O2/c1-20-13-8-10-5-7-18-12(4-3-6-19-15(16)17)11(10)9-14(13)21-2/h8-9,12,18H,3-7H2,1-2H3,(H4,16,17,19)
InChIKey: FRROOMGFBCWJRP-UHFFFAOYSA-N
Reference
Novel bioactive isoquinoline alkaloids from Carduus crispus
PubChem CID: 10357001
CAS: 474304-20-6
LOTUS: LTS0240153
COCONUT: CNP0376811.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Carduus crispus | Carduus | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 292.38300000000004
TPSA？: 92.39
MolLogP？: 1.1538700000000004
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|