4-(2-Nitroethyl)phenol; O-[β-D-Apiofuranosyl-(1→6)-β-D-glucopyranoside]
AlkaPlorer ID: AK307866
Synonym: 6'-Apiofuranosylthalictoside
IUPAC Name: None
Structure
SMILES: O=[N+]([O-])CCC1=CC=C(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)C=C1
InChI: InChI=1S/C19H27NO12/c21-8-19(26)9-30-18(16(19)25)29-7-12-13(22)14(23)15(24)17(32-12)31-11-3-1-10(2-4-11)5-6-20(27)28/h1-4,12-18,21-26H,5-9H2
InChIKey: GVFCXNBFDQOBRP-UHFFFAOYSA-N
Reference
CAS: 887235-32-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Schisandra propinqua | Schisandra | Schisandraceae | Austrobaileyales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 461.4200000000001
TPSA？: 201.44
MolLogP？: -2.8505999999999974
Number of H-Donors: 6
Number of H-Acceptors: 12
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|