Fumaricine; (-)-form, O2-De-Me, N-Me
AlkaPlorer ID: AK298774
Synonym: Fumaritine N-methosalt
IUPAC Name: None
Structure
SMILES: COC1=CC2=C(C=C1O)C1(CC3=CC=C4OCOC4=C3C1O)[N+](C)(C)CC2
InChI: InChI=1S/C21H23NO5/c1-22(2)7-6-12-8-17(25-3)15(23)9-14(12)21(22)10-13-4-5-16-19(27-11-26-16)18(13)20(21)24/h4-5,8-9,20,24H,6-7,10-11H2,1-3H3/p+1
InChIKey: KPRRRNIGFQZOTJ-UHFFFAOYSA-O
Reference
CAS: 82054-20-4
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fumaria muralis | Fumaria | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 370.4250000000001
TPSA？: 68.15
MolLogP？: 2.247
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|