Balfourodine
AlkaPlorer ID: AK005425
Synonym: '', 'Balfourodine'
IUPAC Name: (2S)-2-(2-hydroxypropan-2-yl)-8-methoxy-9-methyl-2,3-dihydrofuro[2,3-b]quinolin-4-one
Structure
SMILES: COC1=CC=CC2=C1N(C)C1=C(C[C@@H](C(C)(C)O)O1)C2=O
InChI: InChI=1S/C16H19NO4/c1-16(2,19)12-8-10-14(18)9-6-5-7-11(20-4)13(9)17(3)15(10)21-12/h5-7,12,19H,8H2,1-4H3/t12-/m0/s1
InChIKey: VPNKCPHNFBSHAP-LBPRGKRZSA-N
Reference
Alkaloids of Balfourodendron riedelianum. Balfourodine and Isobalfourodine
PubChem CID: 101289744
LOTUS: LTS0210901
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lunasia amara | Lunasia | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 289.331
TPSA？: 60.690000000000005
MolLogP？: 1.6214999999999995
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|