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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H24N2O10
Molecular Weight 428.3906
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2S,3S,4S,5R,6S)-6-(((1R)-2-(BENZYLAMINO)-1-(METHOXYMETHYL)-2-OXO-ETHYL)CARBAMOYLOXY)-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID

SMILES

COC[C@@H](NC(=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C(=O)NCC2=CC=CC=C2

InChI

InChIKey=RODXXFMSBBSTDC-LZQHRPSPSA-N
InChI=1S/C18H24N2O10/c1-28-8-10(15(24)19-7-9-5-3-2-4-6-9)20-18(27)30-17-13(23)11(21)12(22)14(29-17)16(25)26/h2-6,10-14,17,21-23H,7-8H2,1H3,(H,19,24)(H,20,27)(H,25,26)/t10-,11+,12+,13-,14+,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H24N2O10
Molecular Weight 428.3906
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:04:48 GMT 2023
Edited
by admin
on Sat Dec 16 15:04:48 GMT 2023
Record UNII
XN2NC9NAH8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S,3S,4S,5R,6S)-6-(((1R)-2-(BENZYLAMINO)-1-(METHOXYMETHYL)-2-OXO-ETHYL)CARBAMOYLOXY)-3,4,5-TRIHYDROXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID
Systematic Name English
LACOSAMIDE METABOLITE M6
Common Name English
Code System Code Type Description
PUBCHEM
156596699
Created by admin on Sat Dec 16 15:04:48 GMT 2023 , Edited by admin on Sat Dec 16 15:04:48 GMT 2023
PRIMARY
FDA UNII
XN2NC9NAH8
Created by admin on Sat Dec 16 15:04:48 GMT 2023 , Edited by admin on Sat Dec 16 15:04:48 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MINOR
URINE