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Pronuciferine

CAT: 0931-T34143-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T34143-01Size:100 mg
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CAS Number
2128-60-1
Bioactivity
Pronuciferine ameliorate the glucose and lipid metabolism in insulin-resistant 3T3-L1 adipocytes.
Smiles
O(C)C1=C2C3(C[C@@]4(C2=C(C=C1OC)CCN4C)[H])C=CC(=O)C=C3
Molecular Formula
C19H21NO3
Molecular Weight
311.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pronuciferine

(+)-pronuciferine is an isoquinoline alkaloid isolated from Berberis coletioides. It has a role as a plant metabolite. It is an isoquinoline alkaloid, a member of isoquinolines, an aromatic ether, an organic heterotetracyclic compound and a cyclic ketone.

CAS Number2128-60-1
PubChem CID200480
IUPAC Name(4R)-10,11-dimethoxy-5-methylspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,4'-cyclohexa-2,5-diene]-1'-one
Molecular FormulaC19H21NO3
Molecular Weight311.4
XLogP2.5
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity539
SMILES
CN1CCC2=CC(=C(C3=C2[C@H]1CC34C=CC(=O)C=C4)OC)OC
InChI
InChI=1S/C19H21NO3/c1-20-9-6-12-10-15(22-2)18(23-3)17-16(12)14(20)11-19(17)7-4-13(21)5-8-19/h4-5,7-8,10,14H,6,9,11H2,1-3H3/t14-/m1/s1
InChIKey
WUYQEGNOQLRQAQ-CQSZACIVSA-N
Chemical Structure
2D Structure
2D structure of Pronuciferine
CAS: 2128-60-1
CID: 200480
Formula: C19H21NO3
MW: 311.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight311.4
XLogP32.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass311.15214353
Monoisotopic Mass311.15214353
Topological Polar Surface Area38.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity539
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
MBS5783667Pronuciferine

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