3,8-Dihydroxy-3,10(14)-guaiadien-12,6-olid-13-oic acid; (1α,5α,6α,8α,11α)-form, 8-O-(3-Piperidinyl), 3-O-β-D-glucopyranoside
AlkaPlorer ID: AK226228
Synonym: None
IUPAC Name: 9-methyl-6-methylidene-2-oxo-4-piperidin-3-yloxy-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,3a,4,5,6a,7,9a,9b-octahydroazuleno[4,5-b]furan-3-carboxylic acid
Structure
SMILES: C=C1CC(OC2CCCNC2)C2C(C(=O)O)C(=O)OC2C2C(C)=C(OC3OC(CO)C(O)C(O)C3O)CC12
InChI: InChI=1S/C26H37NO11/c1-10-6-15(35-12-4-3-5-27-8-12)18-19(24(32)33)25(34)38-23(18)17-11(2)14(7-13(10)17)36-26-22(31)21(30)20(29)16(9-28)37-26/h12-13,15-23,26-31H,1,3-9H2,2H3,(H,32,33)
InChIKey: CNKIBFUYXUADJG-UHFFFAOYSA-N
Reference
Studies on the Constituents of Whole Plants of Youngia japonica
PubChem CID: 74941799
LOTUS: LTS0248557
COCONUT: CNP0286426
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Youngia japonica | Youngia | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 539.5780000000002
TPSA？: 184.24
MolLogP？: -0.947499999999996
Number of H-Donors: 6
Number of H-Acceptors: 11
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|