Schumagnine; N-Me
AlkaPlorer ID: AK313098
Synonym: N-Methylschumagnine
IUPAC Name: 9-hydroxy-5,14-dimethyl-4,12-dioxa-14-azatetracyclo[11.3.1.02,11.03,8]heptadeca-2(11),3(8),5,9-tetraen-7-one
Structure
SMILES: CC1=CC(=O)C2=C(O)C=C3OC4CC(CCN4C)C3=C2O1
InChI: InChI=1S/C16H17NO4/c1-8-5-10(18)15-11(19)7-12-14(16(15)20-8)9-3-4-17(2)13(6-9)21-12/h5,7,9,13,19H,3-4,6H2,1-2H3
InChIKey: FSKXBKAQCJOMBV-UHFFFAOYSA-N
Reference
CAS: 160155-41-9
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Schumanniophyton magnificum | Schumanniophyton | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 287.315
TPSA？: 62.91
MolLogP？: 2.33472
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|