(2,4-Dihydroxyphenyl)acetic acid; Nitrile, 2-O-[3,4,5-trihydroxybenzoyl-(→6)-β-D-glucopyranoside]
AlkaPlorer ID: AK296386
Synonym: None
IUPAC Name: None
Structure
SMILES: N#CCC1=CC=C(O)C=C1OC1OC(COC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O
InChI: InChI=1S/C21H21NO11/c22-4-3-9-1-2-11(23)7-14(9)32-21-19(29)18(28)17(27)15(33-21)8-31-20(30)10-5-12(24)16(26)13(25)6-10/h1-2,5-7,15,17-19,21,23-29H,3,8H2
InChIKey: QLBRKVIIYGHSFO-UHFFFAOYSA-N
Reference
CAS: 1883386-56-8
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Glochidion | Phyllanthaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 463.3950000000001
TPSA？: 210.16
MolLogP？: -0.3815200000000003
Number of H-Donors: 7
Number of H-Acceptors: 12
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|