U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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
139594
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

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

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:09:59 GMT 2023
Edited
by admin
on Sat Dec 16 09:09:59 GMT 2023
Record UNII
NPL21M0A40
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PELLETIERINE, (±)-
Common Name English
ISOPELLETIERINE
MI  
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 Sat Dec 16 09:09:59 GMT 2023 , Edited by admin on Sat Dec 16 09:09:59 GMT 2023
PRIMARY
PUBCHEM
92987
Created by admin on Sat Dec 16 09:09:59 GMT 2023 , Edited by admin on Sat Dec 16 09:09:59 GMT 2023
PRIMARY
CAS
4396-01-4
Created by admin on Sat Dec 16 09:09:59 GMT 2023 , Edited by admin on Sat Dec 16 09:09:59 GMT 2023
PRIMARY
MERCK INDEX
m8451
Created by admin on Sat Dec 16 09:09:59 GMT 2023 , Edited by admin on Sat Dec 16 09:09:59 GMT 2023
PRIMARY Merck Index
FDA UNII
NPL21M0A40
Created by admin on Sat Dec 16 09:09:59 GMT 2023 , Edited by admin on Sat Dec 16 09:09:59 GMT 2023
PRIMARY
ECHA (EC/EINECS)
224-523-0
Created by admin on Sat Dec 16 09:09:59 GMT 2023 , Edited by admin on Sat Dec 16 09:09:59 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966