Chinese bittersweet alkaloid I
AlkaPlorer ID: AK039719
Synonym: ''
IUPAC Name: methyl (2R,4S)-2-(1H-pyrrol-2-yl)-1,3-oxazinane-4-carboxylate
Structure
SMILES: COC(=O)[C@@H]1CCO[C@H](C2=CC=CN2)N1
InChI: InChI=1S/C10H14N2O3/c1-14-10(13)8-4-6-15-9(12-8)7-3-2-5-11-7/h2-3,5,8-9,11-12H,4,6H2,1H3/t8-,9+/m0/s1
InChIKey: WYJTXYYWNRUUBH-DTWKUNHWSA-N
Reference
Two alkaloids from Chinese bittersweet Celastrus angulatus
PubChem CID: 15484334
LOTUS: LTS0046932
NPASS: NPC222317
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Celastrus angulatus | Celastrus | Celastraceae | Celastrales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 210.2330000000001
TPSA？: 63.35
MolLogP？: 0.5647999999999999
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|