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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19NO3.HI
Molecular Weight 365.2073
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PELLOTINE HYDRIODIDE

SMILES

I.COC1=C(OC)C(O)=C2[C@H](C)N(C)CCC2=C1

InChI

InChIKey=MBQXFPPKAYWWII-QRPNPIFTSA-N
InChI=1S/C13H19NO3.HI/c1-8-11-9(5-6-14(8)2)7-10(16-3)13(17-4)12(11)15;/h7-8,15H,5-6H2,1-4H3;1H/t8-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C13H19NO3
Molecular Weight 237.2949
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula HI
Molecular Weight 127.91241
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:00:29 GMT 2025
Edited
by admin
on Mon Mar 31 23:00:29 GMT 2025
Record UNII
5X47KA5D1Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PELLOTINE HYDRIODIDE [MI]
Preferred Name English
PELLOTINE HYDRIODIDE
MI  
Common Name English
(S)-6,7-DIMETHOXY-1,2-DIMETHYL-1,2,3,4-TETRAHYDROISOQUINOLIN-8-OL HYDROIODIDE
Systematic Name English
Code System Code Type Description
MERCK INDEX
m8453
Created by admin on Mon Mar 31 23:00:29 GMT 2025 , Edited by admin on Mon Mar 31 23:00:29 GMT 2025
PRIMARY Merck Index
FDA UNII
5X47KA5D1Q
Created by admin on Mon Mar 31 23:00:29 GMT 2025 , Edited by admin on Mon Mar 31 23:00:29 GMT 2025
PRIMARY
PUBCHEM
76955839
Created by admin on Mon Mar 31 23:00:29 GMT 2025 , Edited by admin on Mon Mar 31 23:00:29 GMT 2025
PRIMARY