Thaicanine; (S)-form, 4-O-β-D-Glucopyranoside
AlkaPlorer ID: AK315693
Synonym: Thaicanine 4-glucoside
IUPAC Name: 2-(hydroxymethyl)-6-[(2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-4-yl)oxy]oxane-3,4,5-triol
Structure
SMILES: COC1=CC=C2CC3C4=CC(OC)=C(OC)C(OC5OC(CO)C(O)C(O)C5O)=C4CCN3CC2=C1OC
InChI: InChI=1S/C27H35NO10/c1-33-18-6-5-13-9-17-15-10-19(34-2)26(36-4)25(14(15)7-8-28(17)11-16(13)24(18)35-3)38-27-23(32)22(31)21(30)20(12-29)37-27/h5-6,10,17,20-23,27,29-32H,7-9,11-12H2,1-4H3
InChIKey: UIGOGNISHXJJFT-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stephania rotunda | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 533.5740000000002
TPSA？: 139.54000000000002
MolLogP？: 0.5551999999999999
Number of H-Donors: 4
Number of H-Acceptors: 11
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|