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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H27NO4
Molecular Weight 297.3899
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HELEURINE

SMILES

CO[C@H](C)[C@@](O)(C(C)C)C(=O)OCC1=CCN2CCC[C@@H]12

InChI

InChIKey=AORFDVNAPHMKAU-INWMFGNUSA-N
InChI=1S/C16H27NO4/c1-11(2)16(19,12(3)20-4)15(18)21-10-13-7-9-17-8-5-6-14(13)17/h7,11-12,14,19H,5-6,8-10H2,1-4H3/t12-,14+,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H27NO4
Molecular Weight 297.3899
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:56:47 GMT 2025
Edited
by admin
on Mon Mar 31 22:56:47 GMT 2025
Record UNII
08X0R3476G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-89940
Preferred Name English
HELEURINE
Common Name English
O3-METHYLSUPININE
Common Name English
BUTANOIC ACID, 2-HYDROXY-2-(1-METHOXYETHYL)-3-METHYL-, (2,3,5,7A-TETRAHYDRO-1H-PYRROLIZIN-7-YL)METHYL ESTER, (7AS-(7(2R*(S*)),7AR*))-
Systematic Name English
(-)-HELIOTRIC ACID ESTER WITH SUPINIDINE
Common Name English
(-)-HELEURINE
Common Name English
HELEURINE, (-)-
Common Name English
BUTANOIC ACID, 2-HYDROXY-2-((1R)-1-METHOXYETHYL)-3-METHYL-, ((7AS)-2,3,5,7A-TETRAHYDRO-1H-PYRROLIZIN-7-YL)METHYL ESTER, (2S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
12310403
Created by admin on Mon Mar 31 22:56:47 GMT 2025 , Edited by admin on Mon Mar 31 22:56:47 GMT 2025
PRIMARY
CAS
488-00-6
Created by admin on Mon Mar 31 22:56:47 GMT 2025 , Edited by admin on Mon Mar 31 22:56:47 GMT 2025
PRIMARY
FDA UNII
08X0R3476G
Created by admin on Mon Mar 31 22:56:47 GMT 2025 , Edited by admin on Mon Mar 31 22:56:47 GMT 2025
PRIMARY
NSC
89940
Created by admin on Mon Mar 31 22:56:47 GMT 2025 , Edited by admin on Mon Mar 31 22:56:47 GMT 2025
PRIMARY
EPA CompTox
DTXSID40964117
Created by admin on Mon Mar 31 22:56:47 GMT 2025 , Edited by admin on Mon Mar 31 22:56:47 GMT 2025
PRIMARY