Fumariline; (±)-form
AlkaPlorer ID: AK298780
Synonym: None
IUPAC Name: 6'-methylspiro[6H-cyclopenta[g][1,3]benzodioxole-7,5'-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline]-8-one
Structure
SMILES: CN1CCC2=CC3=C(C=C2C12CC1=CC=C4OCOC4=C1C2=O)OCO3
InChI: InChI=1S/C20H17NO5/c1-21-5-4-11-6-15-16(25-9-24-15)7-13(11)20(21)8-12-2-3-14-18(26-10-23-14)17(12)19(20)22/h2-3,6-7H,4-5,8-10H2,1H3
InChIKey: GGQGUBWFVKJOER-UHFFFAOYSA-N
Reference
Alkaloids of fumariaceous plants. LVII. Miscellaneous observations
PubChem CID: 629545
CAS: 20411-03-4
LOTUS: LTS0193081
COCONUT: CNP0270573.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fumaria rostellata | Fumaria | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Fumaria muralis | Fumaria | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 351.3580000000001
TPSA？: 57.23
MolLogP？: 2.2662000000000004
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|