Basic information
- CAS
54383-28-7- Standard SMILES
COc1cc2c3c(c1O)-c1ccccc1C[C@@H]3N(C)CC2- InChIKey
YXVXMURDCBMPRH-AWEZNQCLSA-N- Molecular formula
- C18H19NO2
- Average molar mass
- 281.3 g/mol
- Monoisotopic mass
- 281.14157885
Overview
Lirinidine has been reported in Magnolia officinalis, Neostenanthera gabonensis, and other organisms with data available.
Names & identifiers
- Preferred name
- Lirinidine
- IUPAC
- (6aS)-2-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol
- English name
- lirinidine
- Molecular formula
- C18H19NO2
- Molecular weight
- 281.35
Names & synonyms
Lirinidine54383-28-7(6aS)-2-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol(6aS)-2-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo(de,g)quinolin-1-olRefChem:153649(S)-2-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-olorb1297301SCHEMBL29467728SCHEMBL41949472HY-N2307AGLXC-01668NSC785159
Show more names
IirinidineLirinidine, 10 mM in DMSO(6aS)-2-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quin olin-1-ol(6aS)-5,6,6aα,7-Tetrahydro-2-methoxy-6-methyl-4H-dibenzo[de,g]quinolin-1-ol4H-Dibenzo[de,g]quinolin-1-ol, 5,6,6a,7-tetrahydro-2-methoxy-6-methyl-, (6aS)-anticancer,Inhibitor,radical scavenge,antioxidant,cosmetic,Lirinidine,(+)-Lirinidine,inhibit,ferric reducing
NSC785170TN1873AKOS040760523EBC-616814NSC-785159NSC-785170DA-75034MS-23998
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 387
Physicochemical properties
- Boiling point
- 451.4 · 451.4±45.0 °C(Predicted)
- Density
- 1.216 · 1.216±0.06 g/cm3(Predicted)
- pka
- 9.9 · 9.90±0.20(Predicted)
- form
- Solid
- color
- White to off-white
Chemistry & industry
Applications
UsesLirinidine ((+)-Lirinidine) is an alkaloid isolated from the leaves ofL. tulipifera and has antioxidant and anticanceractivities. Lirinidine exhibits medium ferric reducing power activity and minor radical scavenging activity in vitro. Lirinidine can be used for cosmetic research[1].
Suppliers35 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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