1-(2-Aminoethyl)-3,4,5,6-tetrahydroxy-9H-fluoren-9-one; 3,5,6-Tri-Me ether, N,N-di-Me
AlkaPlorer ID: AK257445
Synonym: 1-[2-(Dimethylamino)ethyl]-4-hydroxy-3,5,6-trimethoxy-9H-fluoren-9-one, Caulophylline A
IUPAC Name: 1-[2-(dimethylamino)ethyl]-4-hydroxy-3,5,6-trimethoxyfluoren-9-one
Structure
SMILES: COC1=C(O)C2=C(C(=O)C3=C2C(OC)=C(OC)C=C3)C(CCN(C)C)=C1
InChI: InChI=1S/C20H23NO5/c1-21(2)9-8-11-10-14(25-4)19(23)17-15(11)18(22)12-6-7-13(24-3)20(26-5)16(12)17/h6-7,10,23H,8-9H2,1-5H3
InChIKey: YCJMMOZHYTZHHN-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Caulophyllum robustum | Caulophyllum | Berberidaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 357.4060000000001
TPSA？: 68.23
MolLogP？: 2.733500000000001
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|