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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H26N2.C7H11NO5
Molecular Weight 435.557
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-1-(2-PIPERIDINOPHENYL)-1-BUTYLAMINE, (S)-, N-ACETYL-L-GLUTAMATE

SMILES

CC(=O)N[C@@H](CCC(O)=O)C(O)=O.CC(C)C[C@H](N)C1=CC=CC=C1N2CCCCC2

InChI

InChIKey=YPDMBMNFFPWTOV-NXMISADUSA-N
InChI=1S/C16H26N2.C7H11NO5/c1-13(2)12-15(17)14-8-4-5-9-16(14)18-10-6-3-7-11-18;1-4(9)8-5(7(12)13)2-3-6(10)11/h4-5,8-9,13,15H,3,6-7,10-12,17H2,1-2H3;5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)/t15-;5-/m00/s1

HIDE SMILES / InChI

Molecular Formula C16H26N2
Molecular Weight 246.391
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C7H11NO5
Molecular Weight 189.1659
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:26:01 GMT 2023
Edited
by admin
on Sat Dec 16 09:26:01 GMT 2023
Record UNII
1U5Q8KD140
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYL-1-(2-PIPERIDINOPHENYL)-1-BUTYLAMINE, (S)-, N-ACETYL-L-GLUTAMATE
Systematic Name English
REPAGLINIDE RELATED COMPOUND A [USP-RS]
Common Name English
L-GLUTAMIC ACID, N-ACETYL-, COMPD. WITH (.ALPHA.S)-.ALPHA.-(2-METHYLPROPYL)-2-(1-PIPERIDINYL)BENZENEMETHANAMINE (1:1)
Systematic Name English
REPAGLINIDE RELATED COMPOUND A
USP  
Common Name English
REPAGLINIDE RELATED COMPOUND A [USP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
56965742
Created by admin on Sat Dec 16 09:26:01 GMT 2023 , Edited by admin on Sat Dec 16 09:26:01 GMT 2023
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EPA CompTox
DTXSID50176421
Created by admin on Sat Dec 16 09:26:01 GMT 2023 , Edited by admin on Sat Dec 16 09:26:01 GMT 2023
PRIMARY
CAS
219921-94-5
Created by admin on Sat Dec 16 09:26:01 GMT 2023 , Edited by admin on Sat Dec 16 09:26:01 GMT 2023
PRIMARY
FDA UNII
1U5Q8KD140
Created by admin on Sat Dec 16 09:26:01 GMT 2023 , Edited by admin on Sat Dec 16 09:26:01 GMT 2023
PRIMARY
RS_ITEM_NUM
1600824
Created by admin on Sat Dec 16 09:26:01 GMT 2023 , Edited by admin on Sat Dec 16 09:26:01 GMT 2023
PRIMARY