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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H27NO6
Molecular Weight 365.4208
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SENKIRKINE

SMILES

C\C=C1\C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN(C)CC[C@@H](OC1=O)C2=O

InChI

InChIKey=HPDHKHMHQGCNPE-QLJRNOHWSA-N
InChI=1S/C19H27NO6/c1-5-13-10-12(2)19(3,24)18(23)25-11-14-6-8-20(4)9-7-15(16(14)21)26-17(13)22/h5-6,12,15,24H,7-11H2,1-4H3/b13-5-,14-6-/t12-,15-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H27NO6
Molecular Weight 365.4208
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Disturbance of gene expression in primary human hepatocytes by hepatotoxic pyrrolizidine alkaloids: A whole genome transcriptome analysis.
2015-10
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:39:38 GMT 2025
Edited
by admin
on Mon Mar 31 22:39:38 GMT 2025
Record UNII
X65P7V4LVJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SENKIRKINE
Common Name English
NSC-89945
Preferred Name English
SENKIRKINE [IARC]
Common Name English
2,9-DIOXA-14-AZABICYCLO(9.5.1)HEPTADEC-11-ENE-3,8,17-TRIONE, 4-ETHYLIDENE-7-HYDROXY-6,7,14-TRIMETHYL-, (1R,4Z,6R,7R)-
Systematic Name English
RENARDINE
Common Name English
SENKIRKIN
Common Name English
(1R,4Z,6R,7R)-4-ETHYLIDENE-7-HYDROXY-6,7,14-TRIMETHYL-2,9-DIOXA-14-AZABICYCLO(9.5.1)HEPTADEC-11-ENE-3,8,17-TRIONE
Systematic Name English
RENARDIN
Common Name English
Code System Code Type Description
NSC
89945
Created by admin on Mon Mar 31 22:39:38 GMT 2025 , Edited by admin on Mon Mar 31 22:39:38 GMT 2025
PRIMARY
FDA UNII
X65P7V4LVJ
Created by admin on Mon Mar 31 22:39:38 GMT 2025 , Edited by admin on Mon Mar 31 22:39:38 GMT 2025
PRIMARY
CAS
2318-18-5
Created by admin on Mon Mar 31 22:39:38 GMT 2025 , Edited by admin on Mon Mar 31 22:39:38 GMT 2025
PRIMARY
HSDB
3536
Created by admin on Mon Mar 31 22:39:38 GMT 2025 , Edited by admin on Mon Mar 31 22:39:38 GMT 2025
PRIMARY
PUBCHEM
5281752
Created by admin on Mon Mar 31 22:39:38 GMT 2025 , Edited by admin on Mon Mar 31 22:39:38 GMT 2025
PRIMARY
EPA CompTox
DTXSID4021266
Created by admin on Mon Mar 31 22:39:38 GMT 2025 , Edited by admin on Mon Mar 31 22:39:38 GMT 2025
PRIMARY
CAS
6882-01-5
Created by admin on Mon Mar 31 22:39:38 GMT 2025 , Edited by admin on Mon Mar 31 22:39:38 GMT 2025
ALTERNATIVE
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
PARENT -> CONSTITUENT ALWAYS PRESENT
Butterbur root alkaloid.
PARENT -> CONSTITUENT ALWAYS PRESENT
PARENT -> CONSTITUENT ALWAYS PRESENT