4,5,6-Trihydroxy-2-cyclohexen-1-ylideneacetonitrile; (1Z,4R,5S,6S)-form, 4-Me ether, 6-O-β-D-glucopyranoside
AlkaPlorer ID: AK316530
Synonym: Bauhinin
IUPAC Name: 2-[5-hydroxy-4-methoxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohex-2-en-1-ylidene]acetonitrile
Structure
SMILES: COC1C=CC(=CC#N)C(OC2OC(CO)C(O)C(O)C2O)C1O
InChI: InChI=1S/C15H21NO8/c1-22-8-3-2-7(4-5-16)14(11(8)19)24-15-13(21)12(20)10(18)9(6-17)23-15/h2-4,8-15,17-21H,6H2,1H3
InChIKey: LZYYZVIACZQHFH-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Bauhinia championii | Bauhinia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 343.33200000000005
TPSA？: 152.63
MolLogP？: -2.432819999999998
Number of H-Donors: 5
Number of H-Acceptors: 9
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|