Kopsinine; Parent acid, N1-formyl, N4-oxide
AlkaPlorer ID: AK303747
Synonym: N1-Formylkopsininic acid N4-oxide
IUPAC Name: None
Structure
SMILES: O=CN1C2=CC=CC=C2C23CC[N+]4([O-])CCCC5(CCC12C(C(=O)O)C5)C34
InChI: InChI=1S/C21H24N2O4/c24-13-22-16-5-2-1-4-14(16)20-9-11-23(27)10-3-6-19(18(20)23)7-8-21(20,22)15(12-19)17(25)26/h1-2,4-5,13,15,18H,3,6-12H2,(H,25,26)
InChIKey: AGZHUPIPORRGEL-UHFFFAOYSA-N
Reference
CAS: 1583366-84-0
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kopsia singapurensis | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 368.4330000000001
TPSA？: 80.67
MolLogP？: 2.405
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|