1,2-Dihydroxyaporphine; (R)-form, O1-Me, N-de-Me, N-ethoxycarbonyl, 2-O-β-D-glucopyranoside
AlkaPlorer ID: AK296019
Synonym: Kamaline
IUPAC Name: ethyl 1-methoxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-carboxylate
Structure
SMILES: CCOC(=O)N1CCC2=C3C(=C(OC)C(OC4OC(CO)C(O)C(O)C4O)=C2)C2=CC=CC=C2CC31
InChI: InChI=1S/C26H31NO9/c1-3-34-26(32)27-9-8-14-11-17(35-25-23(31)22(30)21(29)18(12-28)36-25)24(33-2)20-15-7-5-4-6-13(15)10-16(27)19(14)20/h4-7,11,16,18,21-23,25,28-31H,3,8-10,12H2,1-2H3
InChIKey: XPLYQICAQFRBTJ-UHFFFAOYSA-N
Reference
Kamaline, an unusual aporphine alkaloid, from Stephania venosa
PubChem CID: 162903364
CAS: 157207-94-8
LOTUS: LTS0060875
COCONUT: CNP0171625.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stephania venosa | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 501.53200000000015
TPSA？: 138.15
MolLogP？: 1.1526999999999996
Number of H-Donors: 4
Number of H-Acceptors: 9
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|