2-Hydroxy-2-methylpropanoic acid; Nitrile, O-[3,4,5-trihydroxybenzoyl-(→6)-β-D-glucopyranoside]
AlkaPlorer ID: AK301559
Synonym: 6'-O-Galloyllinamarin
IUPAC Name: None
Structure
SMILES: CC(C)(C#N)OC1OC(COC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O
InChI: InChI=1S/C17H21NO10/c1-17(2,6-18)28-16-14(24)13(23)12(22)10(27-16)5-26-15(25)7-3-8(19)11(21)9(20)4-7/h3-4,10,12-14,16,19-24H,5H2,1-2H3
InChIKey: HYSHYANUCBRQBS-UHFFFAOYSA-N
Reference
CAS: 1661914-44-8
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Micranthus | Iridaceae | Asparagales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 399.352
TPSA？: 189.93
MolLogP？: -0.9134200000000005
Number of H-Donors: 6
Number of H-Acceptors: 11
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|