Uncariagambiriine
AlkaPlorer ID: AK253009
Synonym: None
IUPAC Name: methyl 14-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-1,3,11,12,14,21-hexahydroyohimban-19-carboxylate
Structure
SMILES: COC(=O)C1=CC=CC2=C1CC1C3=C(CCN1C2C1=C(O)C=C(O)C2=C1OC(C1=CC=C(O)C(O)=C1)C(O)C2)C1=CC=CC=C1N3
InChI: InChI=1S/C36H32N2O8/c1-45-36(44)21-7-4-6-20-22(21)14-25-32-19(18-5-2-3-8-24(18)37-32)11-12-38(25)33(20)31-29(42)16-27(40)23-15-30(43)34(46-35(23)31)17-9-10-26(39)28(41)13-17/h2-10,13,16,25,30,33-34,37,39-43H,11-12,14-15H2,1H3
InChIKey: KQIDPZSWBQHVBA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Uncaria gambir | Uncaria | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 620.6580000000001
TPSA？: 155.71
MolLogP？: 5.058900000000008
Number of H-Donors: 6
Number of H-Acceptors: 9
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|