Fumaritine
AlkaPlorer ID: AK001658
Synonym: '', 'Fumaritine'
IUPAC Name: (1R,8'R)-6-methoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6,8-dihydrocyclopenta[g][1,3]benzodioxole]-7,8'-diol
Structure
SMILES: COC1=CC2=C(C=C1O)[C@@]1(CC3=CC=C4OCOC4=C3[C@H]1O)N(C)CC2
InChI: InChI=1S/C20H21NO5/c1-21-6-5-11-7-16(24-2)14(22)8-13(11)20(21)9-12-3-4-15-18(26-10-25-15)17(12)19(20)23/h3-4,7-8,19,22-23H,5-6,9-10H2,1-2H3/t19-,20-/m1/s1
InChIKey: YUIGSRGRYOBFRF-WOJBJXKFSA-N
Reference
Alkaloids of fumariaceous plants. LVII. Miscellaneous observations
PubChem CID: 12309932
LOTUS: LTS0088692
SuperNatural Ⅲ: SN0460504-04
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fumaria schleicheri | Fumaria | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 355.3900000000001
TPSA？: 71.39
MolLogP？: 2.1024000000000003
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|