Cavidine; (±)-form, 1-Nitro, O2-de-Me
AlkaPlorer ID: AK291843
Synonym: 1-Nitroapocavidine
IUPAC Name: 17-methoxy-12-methyl-15-nitro-5,7-dioxa-1-azapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-16-ol
Structure
SMILES: COC1=CC2=C(C([N+](=O)[O-])=C1O)C1C(C)C3=CC=C4OCOC4=C3CN1CC2
InChI: InChI=1S/C20H20N2O6/c1-10-12-3-4-14-20(28-9-27-14)13(12)8-21-6-5-11-7-15(26-2)19(23)18(22(24)25)16(11)17(10)21/h3-4,7,10,17,23H,5-6,8-9H2,1-2H3
InChIKey: YGVSSEZMMJWCON-UHFFFAOYSA-N
Reference
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Corydalis saxicola | Corydalis | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 384.3880000000003
TPSA？: 94.3
MolLogP？: 3.2542000000000018
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|