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Vindolinine

CAT: 1410-M31615-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Vindolinine is a natural product from Catharanthus roseus (L.) G. Don.
CAS Number
5980-02-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
336.43
Molecular Formula
C21H24N2O2
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Vindolinine

Vindolinine is a monoterpenoid indole alkaloid with formula C21H24N2O2, isolated from several plant species. It has a role as a plant metabolite. It is a methyl ester, an organic heteropentacyclic compound, a tertiary amino compound and a monoterpenoid indole alkaloid.

CAS Number5980-02-9
PubChem CID24148538
IUPAC Namemethyl (1R,9R,10R,12R,19S,20R)-20-methyl-8,16-diazahexacyclo[10.6.1.19,12.01,9.02,7.016,19]icosa-2,4,6,13-tetraene-10-carboxylate
Molecular FormulaC21H24N2O2
Molecular Weight336.4
XLogP2.9
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity677
SMILES
C[C@@H]1[C@]23C[C@H]([C@@]14[C@@]5([C@H]2N(CC5)CC=C3)C6=CC=CC=C6N4)C(=O)OC
InChI
InChI=1S/C21H24N2O2/c1-13-19-8-5-10-23-11-9-20(18(19)23)14-6-3-4-7-16(14)22-21(13,20)15(12-19)17(24)25-2/h3-8,13,15,18,22H,9-12H2,1-2H3/t13-,15+,18+,19+,20-,21-/m1/s1
InChIKey
JSLDLCGKZDUQSH-SBDPWIONSA-N
Chemical Structure
2D Structure
2D structure of Vindolinine
CAS: 5980-02-9
CID: 24148538
Formula: C21H24N2O2
MW: 336.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight336.4
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass336.183778013
Monoisotopic Mass336.183778013
Topological Polar Surface Area41.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity677
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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