Products for Research Use Only
RegisterLogin

Laurifoline

CAT: 0926-HAA22461-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-HAA22461-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
7224-61-5
MDL Number
MFCD02751916
Smiles
C[N+]1 (CCC2=CC (=C (C3=C2C1CC4=CC (=C (C=C43) OC) O) O) OC) C
Molecular Formula
C20H24NO4+
Molecular Weight
342.4 g/mol
Controlled
No

Chemical Information

Laurifoline

(9S)-5,16-dihydroxy-4,15-dimethoxy-10,10-dimethyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-10-ium has been reported in Hypserpa nitida, Sinomenium acutum, and other organisms with data available.

CAS Number7224-61-5
PubChem CID12305611
IUPAC Name(6aS)-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-1,9-diol
Molecular FormulaC20H24NO4+
Molecular Weight342.4
XLogP2.7
Topological Polar Surface Area58.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge1
Complexity498
SMILES
C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)O)OC)C
InChI
InChI=1S/C20H23NO4/c1-21(2)6-5-11-9-17(25-4)20(23)19-13-10-16(24-3)15(22)8-12(13)7-14(21)18(11)19/h8-10,14H,5-7H2,1-4H3,(H-,22,23)/p+1/t14-/m0/s1
InChIKey
ZDVDVLRYVOZWMP-AWEZNQCLSA-O
Chemical Structure
2D Structure
2D structure of Laurifoline
CAS: 7224-61-5
CID: 12305611
Formula: C20H24NO4+
MW: 342.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.4
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass342.17053325
Monoisotopic Mass342.17053325
Topological Polar Surface Area58.9 Ų
Heavy Atom Count25
Formal Charge1
Complexity498
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19202171-01Laurifoline
TN7386-014-Keto-laurifoline

Popular Products