(2S)-2-(hydroxymethyl)-2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanenitrile
AlkaPlorer ID: AK492693
Synonym: None
IUPAC Name: 2-(hydroxymethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanenitrile
Structure
SMILES: CCC(C#N)(CO)OC1OC(CO)C(O)C(O)C1O
InChI: InChI=1S/C11H19NO7/c1-2-11(4-12,5-14)19-10-9(17)8(16)7(15)6(3-13)18-10/h6-10,13-17H,2-3,5H2,1H3
InChIKey: PQTBFFDFWLSIFO-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rhodiola rosea | Rhodiola | Crassulaceae | Saxifragales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 277.273
TPSA？: 143.4
MolLogP？: -2.532419999999999
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|