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Details

Stereochemistry RACEMIC
Molecular Formula C8H15NO
Molecular Weight 141.2108
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PELLETIERINE, (±)-

SMILES

CC(=O)CC1CCCCN1

InChI

InChIKey=JEIZLWNUBXHADF-UHFFFAOYSA-N
InChI=1S/C8H15NO/c1-7(10)6-8-4-2-3-5-9-8/h8-9H,2-6H2,1H3

HIDE SMILES / InChI
Molecular Formula C8H15NO
Molecular Weight 141.2108
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Description

Pelletierine +/- also known as isopelletierine is an alkaloid found in the root-bark of the pomegranate tree. There is a little information about the pharmacological application of this compound, but one article describes its anthelminthic activity.

Approval Year

Unknown
149124
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
[Synthetic studies on lythraceae alkaloids. I. A convenient synthesis of isopelletierine (author's transl)].
1974-04
The occurrence of isopelletierine in Withania somnifera.
1962-12
The anthelminthic activity of pelletierine and isopelletierine.
1956-12

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:32:10 GMT 2025
Edited
by admin
on Mon Mar 31 22:32:10 GMT 2025
Record UNII
NPL21M0A40
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOPELLETIERINE
MI  
Preferred Name English
PELLETIERINE, (±)-
Common Name English
(±)-PELLETIERINE
Common Name English
2-PROPANONE, 1-(2-PIPERIDINYL)-
Systematic Name English
ISOPUNICINE
Common Name English
ISOPELLETIERINE [MI]
Common Name English
8-METHYLNORLOBELONE
Common Name English
(±)-ISOPELLETIERINE
Common Name English
2-ACETONYLPIPERIDINE
Systematic Name English
ISOPELLETIERIN
Common Name English
DL-PELLETIERINE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00863036
Created by admin on Mon Mar 31 22:32:10 GMT 2025 , Edited by admin on Mon Mar 31 22:32:10 GMT 2025
PRIMARY
PUBCHEM
92987
Created by admin on Mon Mar 31 22:32:10 GMT 2025 , Edited by admin on Mon Mar 31 22:32:10 GMT 2025
PRIMARY
CAS
4396-01-4
Created by admin on Mon Mar 31 22:32:10 GMT 2025 , Edited by admin on Mon Mar 31 22:32:10 GMT 2025
PRIMARY
MERCK INDEX
m8451
Created by admin on Mon Mar 31 22:32:10 GMT 2025 , Edited by admin on Mon Mar 31 22:32:10 GMT 2025
PRIMARY Merck Index
FDA UNII
NPL21M0A40
Created by admin on Mon Mar 31 22:32:10 GMT 2025 , Edited by admin on Mon Mar 31 22:32:10 GMT 2025
PRIMARY
ECHA (EC/EINECS)
224-523-0
Created by admin on Mon Mar 31 22:32:10 GMT 2025 , Edited by admin on Mon Mar 31 22:32:10 GMT 2025
PRIMARY
NIH
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