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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H41NO3
Molecular Weight 367.5658
Optical Activity ( - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE, (2R,3R,6S)-

SMILES

C[C@H]1N[C@@H](CCCCCCCCCCCCC(C)=O)CC[C@H]1OC(C)=O

InChI

InChIKey=LRKWDKCSHJWJST-BAGYTPMASA-N
InChI=1S/C22H41NO3/c1-18(24)14-12-10-8-6-4-5-7-9-11-13-15-21-16-17-22(19(2)23-21)26-20(3)25/h19,21-23H,4-17H2,1-3H3/t19-,21+,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H41NO3
Molecular Weight 367.5658
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 Sat Dec 16 10:48:12 GMT 2023
Edited
by admin
on Sat Dec 16 10:48:12 GMT 2023
Record UNII
N6XK6QHP8K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE, (2R,3R,6S)-
Systematic Name English
(-)-3-O-ACETYLSPECTALINE
Systematic Name English
LASSBIO-767 FREE BASE
Common Name English
14-((2S,5R,6R)-5-(ACETYLOXY)-6-METHYL-2-PIPERIDINYL)-2-TETRADECANONE
Systematic Name English
2-TETRADECANONE, 14-((2S,5R,6R)-5-(ACETYLOXY)-6-METHYL-2-PIPERIDINYL)-
Systematic Name English
(2R,3R,6S)-2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
N6XK6QHP8K
Created by admin on Sat Dec 16 10:48:12 GMT 2023 , Edited by admin on Sat Dec 16 10:48:12 GMT 2023
PRIMARY
CAS
709046-67-3
Created by admin on Sat Dec 16 10:48:12 GMT 2023 , Edited by admin on Sat Dec 16 10:48:12 GMT 2023
PRIMARY
PUBCHEM
10474155
Created by admin on Sat Dec 16 10:48:12 GMT 2023 , Edited by admin on Sat Dec 16 10:48:12 GMT 2023
PRIMARY
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