(2R)-2-{[(2R,3R,4S,5S,6R)-6-({[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-phenylacetonitrile
AlkaPlorer ID: AK482606
Synonym: None
IUPAC Name: 2-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-phenylacetonitrile
Structure
SMILES: N#CC(O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C1=CC=CC=C1
InChI: InChI=1S/C19H25NO10/c20-6-11(10-4-2-1-3-5-10)29-17-15(24)14(23)13(22)12(30-17)7-27-18-16(25)19(26,8-21)9-28-18/h1-5,11-18,21-26H,7-9H2/t11?,12-,13-,14+,15-,16+,17-,18-,19-/m1/s1
InChIKey: OTHGEZFOFRQZOU-PARKKQJRSA-N
Reference
Cyanogenic glycosides from PS Psydrax and Oxyanthus species[a/t]
PubChem CID: 101621381
LOTUS: LTS0002767
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Psydrax livida | Psydrax | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 427.40600000000006
TPSA?: 182.09
MolLogP?: -2.4673199999999973
Number of H-Donors: 6
Number of H-Acceptors: 11
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|
