2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE HYDROCHLORIDE, (2R,3R,6S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H41NO3.ClH
Molecular Weight	404.027
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE HYDROCHLORIDE, (2R,3R,6S)-

Structure Search

SMILES

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

InChI

InChIKey=TXUOSKWTFYTNBN-VZOQGOGTSA-N

InChI=1S/C22H41NO3.ClH/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;1H/t19-,21+,22-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

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	( - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:24:29 GMT 2023` Edited by `admin` on `Sat Dec 16 11:24:29 GMT 2023`
Record UNII	2PC9W67BHD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE HYDROCHLORIDE, (2R,3R,6S)-

Systematic Name

English

2-TETRADECANONE, 14-((2S,5R,6R)-5-(ACETYLOXY)-6-METHYL-2-PIPERIDINYL)-, HYDROCHLORIDE

Systematic Name

English

2-TETRADECANONE, 14-((2S,5R,6R)-5-(ACETYLOXY)-6-METHYL-2-PIPERIDINYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

LASSBIO-767

Code

English

LASSBIO767

Code

English

(2R,3R,6S)-2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE HYDROCHLORIDE

Systematic Name

English

(-)-3-O-ACETYLSPECTALINE HYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

11682845

Created by admin on Sat Dec 16 11:24:29 GMT 2023 , Edited by admin on Sat Dec 16 11:24:29 GMT 2023

PRIMARY

CAS

860033-24-5

Created by admin on Sat Dec 16 11:24:29 GMT 2023 , Edited by admin on Sat Dec 16 11:24:29 GMT 2023

PRIMARY

FDA UNII

2PC9W67BHD

Created by admin on Sat Dec 16 11:24:29 GMT 2023 , Edited by admin on Sat Dec 16 11:24:29 GMT 2023

PRIMARY

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2-METHYL-6-(13-OXOTETRADECYL)PIPERIDIN-3-YL ACETATE, (2R,3R,6S)-

ACTIVE MOIETY