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Details

Stereochemistry EPIMERIC
Molecular Formula C17H21NO9
Molecular Weight 383.3499
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-((2-(4-CARBOXYPHENYL)-1-METHYL-2-OXOETHYL)METHYLAMINO)-1-DEOXY-.BETA.-D-GLUCOPYRANURONIC ACID

SMILES

CC(N(C)[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C(=O)C2=CC=C(C=C2)C(O)=O

InChI

InChIKey=ZQACYKFUUWRWLG-GJBJUZDASA-N
InChI=1S/C17H21NO9/c1-7(10(19)8-3-5-9(6-4-8)16(23)24)18(2)15-13(22)11(20)12(21)14(27-15)17(25)26/h3-7,11-15,20-22H,1-2H3,(H,23,24)(H,25,26)/t7?,11-,12-,13+,14-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H21NO9
Molecular Weight 383.3499
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:25:17 GMT 2023
Edited
by admin
on Sat Dec 16 15:25:17 GMT 2023
Record UNII
F966DI9FFY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-((2-(4-CARBOXYPHENYL)-1-METHYL-2-OXOETHYL)METHYLAMINO)-1-DEOXY-.BETA.-D-GLUCOPYRANURONIC ACID
Systematic Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-((2-(4-CARBOXYPHENYL)-1-METHYL-2-OXOETHYL)METHYLAMINO)-1-DEOXY-
Systematic Name English
MEPHEDRONE METABOLITE M9
Common Name English
Code System Code Type Description
CAS
1826882-15-8
Created by admin on Sat Dec 16 15:25:17 GMT 2023 , Edited by admin on Sat Dec 16 15:25:17 GMT 2023
PRIMARY
FDA UNII
F966DI9FFY
Created by admin on Sat Dec 16 15:25:17 GMT 2023 , Edited by admin on Sat Dec 16 15:25:17 GMT 2023
PRIMARY
PUBCHEM
146014904
Created by admin on Sat Dec 16 15:25:17 GMT 2023 , Edited by admin on Sat Dec 16 15:25:17 GMT 2023
PRIMARY
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