Renierol; 1,2-Dihydro, O-Ac, N-formyl
AlkaPlorer ID: AK036405
Synonym: N-Formyl-1,2-dihydrorenierol acetate
IUPAC Name: (2-formyl-7-methoxy-6-methyl-5,8-dioxo-1H-isoquinolin-1-yl)methyl acetate
Structure
SMILES: COC1=C(C)C(=O)C2=C(C1=O)C(COC(C)=O)N(C=O)C=C2
InChI: InChI=1S/C15H15NO6/c1-8-13(19)10-4-5-16(7-17)11(6-22-9(2)18)12(10)14(20)15(8)21-3/h4-5,7,11H,6H2,1-3H3
InChIKey: FKSJEDLYGKTTKS-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Jorunna funebris | Jorunna | Discodorididae | Nudibranchia | Gastropoda | Mollusca | Metazoa | Eukaryota |
| None | Xestospongia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
| None | Xestospongia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 305.286
TPSA？: 89.98000000000002
MolLogP？: 0.2725999999999999
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|