Glabratine
AlkaPlorer ID: AK299235
Synonym: None
IUPAC Name: methyl 2-(1-hydroxybut-3-en-2-yl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate
Structure
SMILES: C=CC(CO)C1CC2C3=C(CCN2C=C1C(=O)OC)C1=C(OC2OC(CO)C(O)C(O)C2O)C=CC=C1N3
InChI: InChI=1S/C27H34N2O9/c1-3-13(11-30)15-9-18-22-14(7-8-29(18)10-16(15)26(35)36-2)21-17(28-22)5-4-6-19(21)37-27-25(34)24(33)23(32)20(12-31)38-27/h3-6,10,13,15,18,20,23-25,27-28,30-34H,1,7-9,11-12H2,2H3
InChIKey: USUGTFYUSIJKAR-UHFFFAOYSA-N
Reference
Six New Triterpenoid Saponins from the Root and Stem Bark of<i>Cephalanthus occidentalis</i>
PubChem CID: 162967452
LOTUS: LTS0238347
COCONUT: CNP0238894.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Uncaria | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Cephalanthus occidentalis | Cephalanthus | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Uncaria | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 530.5740000000002
TPSA？: 164.94
MolLogP？: 0.1170999999999998
Number of H-Donors: 6
Number of H-Acceptors: 10
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|