Medicosmine
AlkaPlorer ID: AK084824
Synonym: ''
IUPAC Name: 17-methoxy-5,5-dimethyl-6,13-dioxa-11-azatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2(7),3,8,11,14,16-heptaene
Structure
SMILES: COC1=C2C=COC2=NC2=CC=C3OC(C)(C)C=CC3=C12
InChI: InChI=1S/C17H15NO3/c1-17(2)8-6-10-13(21-17)5-4-12-14(10)15(19-3)11-7-9-20-16(11)18-12/h4-9H,1-3H3
InChIKey: WVBLHNOAFTUBSS-UHFFFAOYSA-N
Reference
PubChem CID: 266041
CAS: 35306-86-6
LOTUS: LTS0073539
SuperNatural Ⅲ: SN0420779
COCONUT: CNP0198102
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Medicosma cunninghamii | Medicosma | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 281.31100000000004
TPSA？: 44.49000000000001
MolLogP？: 4.173800000000003
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|