Pareirubrine B
AlkaPlorer ID: AK084991
Synonym: ''
IUPAC Name: 5-hydroxy-15,16-dimethoxy-10-azatetracyclo[7.7.1.02,8.013,17]heptadeca-1(17),2,4,7,9,11,13,15-octaen-6-one
Structure
SMILES: COC1=CC2=CC=NC3=C2C(=C1OC)C1=CC=C(O)C(=O)C=C13
InChI: InChI=1S/C18H13NO4/c1-22-14-7-9-5-6-19-17-11-8-13(21)12(20)4-3-10(11)16(15(9)17)18(14)23-2/h3-8H,1-2H3,(H,20,21)
InChIKey: PIHFTDWSUXZRDI-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Abuta grandifolia | Abuta | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 307.30500000000006
TPSA？: 68.65
MolLogP？: 2.965200000000001
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|