4-Hydroxy-2-(hydroxymethyl)-2-butenoic acid; (Z)-form, Nitrile, 5-O-(4-hydroxy-3-methoxybenzoyl), 4-O-β-D-glucopyranoside
AlkaPlorer ID: AK301198
Synonym: None
IUPAC Name: None
Structure
SMILES: COC1=CC(C(=O)OC/C(C#N)=C\COC2OC(CO)C(O)C(O)C2O)=CC=C1O
InChI: InChI=1S/C19H23NO10/c1-27-13-6-11(2-3-12(13)22)18(26)29-9-10(7-20)4-5-28-19-17(25)16(24)15(23)14(8-21)30-19/h2-4,6,14-17,19,21-25H,5,8-9H2,1H3/b10-4-
InChIKey: UWNLOPFIHDWHDR-WMZJFQQLSA-N
Reference
CAS: 930275-36-8
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ribes rubrum | Ribes | Grossulariaceae | Saxifragales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 425.3900000000001
TPSA？: 178.92999999999998
MolLogP？: -1.17592
Number of H-Donors: 5
Number of H-Acceptors: 11
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|