brachystemidine B
AlkaPlorer ID: AK041585
Synonym: 'Brachystemidine B', '(-)-Brachystemidine B', '(2R)-2-(2-methoxy-5-oxopyrrolidin-1-yl)-2,5-dihydrofuran-3-ylmethyl1H-pyrrole-2-carboxylate'
IUPAC Name: [(2S)-2-[(2R)-2-methoxy-5-oxopyrrolidin-1-yl]-2,5-dihydrofuran-3-yl]methyl 1H-pyrrole-2-carboxylate
Structure
SMILES: CO[C@@H]1CCC(=O)N1[C@H]1OCC=C1COC(=O)C1=CC=CN1
InChI: InChI=1S/C15H18N2O5/c1-20-13-5-4-12(18)17(13)14-10(6-8-21-14)9-22-15(19)11-3-2-7-16-11/h2-3,6-7,13-14,16H,4-5,8-9H2,1H3/t13-,14+/m1/s1
InChIKey: IDTBQXSKCCAGNA-KGLIPLIRSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Brachystemma calycinum | Brachystemma | Caryophyllaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 306.3179999999999
TPSA？: 80.85999999999999
MolLogP？: 1.0491
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|