(3aR,5S)-6-methyl-3a,7-dihydro-2H-3',5',12'-trioxaspiro[[1,3]dioxolo[4,5-g]isoquinoline-5,11'-tricyclo[7.4.0.0²,⁶]tridecane]-1'(9'),2'(6'),7'-trien-10'-one
AlkaPlorer ID: AK154119
Synonym: None
IUPAC Name: (3aR,5S)-6-methylspiro[3a,7-dihydro-[1,3]dioxolo[4,5-g]isoquinoline-5,7'-9H-[1,3]dioxolo[4,5-h]isochromene]-6'-one
Structure
SMILES: CN1CC=C2C=C3OCO[C@@H]3C=C2[C@@]12OCC1=C3OCOC3=CC=C1C2=O
InChI: InChI=1S/C20H17NO6/c1-21-5-4-11-6-16-17(25-9-24-16)7-14(11)20(21)19(22)12-2-3-15-18(26-10-23-15)13(12)8-27-20/h2-4,6-7,17H,5,8-10H2,1H3/t17-,20+/m1/s1
InChIKey: PLEOOFRGOLKPBS-XLIONFOSSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hypecoum erectum | Hypecoum | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 367.35700000000014
TPSA？: 66.46000000000001
MolLogP？: 1.8931
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|