Anagyrine

CAT: 0607-BA5522-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0607-BA5522-5Size:5 mg

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CAS Number

486-89-5

Form

An oil

Molecular Formula

C15H20N2O

Molecular Weight

244.33

Shipping Conditions

Blue ice

Storage Conditions

4°C, protect from light.

Chemical Information

Anagyrine

Monolupine has been reported in Lupinus pilosus, Maackia tenuifolia, and other organisms with data available.

CAS Number	486-89-5
PubChem CID	5351589
IUPAC Name	(1R,9R,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one
Molecular Formula	C15H20N2O
Molecular Weight	244.33
XLogP	1.6
Topological Polar Surface Area	23.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	18
Formal Charge	0
Complexity	440

SMILES

C1CCN2C[C@H]3C[C@@H]([C@H]2C1)CN4C3=CC=CC4=O

InChI

InChI=1S/C15H20N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h3,5-6,11-13H,1-2,4,7-10H2/t11-,12-,13-/m1/s1

InChIKey

FQEQMASDZFXSJI-JHJVBQTASA-N

Chemical Structure

2D Structure

CAS: 486-89-5

CID: 5351589

Formula: C15H20N2O

MW: 244.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	244.33
XLogP3	1.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	244.157563266
Monoisotopic Mass	244.157563266
Topological Polar Surface Area	23.6 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	440
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes