Muramine; O2,O3-Di-de-Me
AlkaPlorer ID: AK128985
Synonym: Vaillantine
IUPAC Name: 10,11-dihydroxy-3,4-dimethoxy-6-methyl-5,7,8,14-tetrahydrobenzo[e][2]benzazecin-13-one
Structure
SMILES: COC1=CC=C2CC(=O)C3=CC(O)=C(O)C=C3CCN(C)CC2=C1OC
InChI: InChI=1S/C20H23NO5/c1-21-7-6-13-9-17(23)18(24)10-14(13)16(22)8-12-4-5-19(25-2)20(26-3)15(12)11-21/h4-5,9-10,23-24H,6-8,11H2,1-3H3
InChIKey: KERJSZZMJYDUGO-UHFFFAOYSA-N
Reference
Alkaloids of Fumaria vaillantii structure of vaillantine
PubChem CID: 163034093
LOTUS: LTS0142403
SuperNatural Ⅲ: SN0183599
COCONUT: CNP0313325
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fumaria vaillantii | Fumaria | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 357.4060000000002
TPSA？: 79.23
MolLogP？: 2.5283000000000007
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|