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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H18N2O8
Molecular Weight 342.3013
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AVR-48

SMILES

CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1OC2=CC=C(C=C2)[N+]([O-])=O

InChI

InChIKey=OMRLTNCLYHKQCK-DHGKCCLASA-N
InChI=1S/C14H18N2O8/c1-7(18)15-11-13(20)12(19)10(6-17)24-14(11)23-9-4-2-8(3-5-9)16(21)22/h2-5,10-14,17,19-20H,6H2,1H3,(H,15,18)/t10-,11-,12-,13-,14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H18N2O8
Molecular Weight 342.3013
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:52:42 UTC 2023
Edited
by admin
on Sat Dec 16 18:52:42 UTC 2023
Record UNII
GVY9AA7Y5C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AVR-48
Code English
.BETA.-D-GLUCOPYRANOSIDE, 4-NITROPHENYL 2-(ACETYLAMINO)-2-DEOXY-
Systematic Name English
N-((2S,3R,4R,5S,6R)-4,5-DIHYDROXY-6-(HYDROXYMETHYL)-2-(4-NITROPHENOXY)TETRAHYDRO-2H-PYRAN-3-YL) ACETAMIDE
Systematic Name English
4-NITROPHENYL-N-ACETYL-BETA-D-GLUCOSAMINIDE
Systematic Name English
4-NITROPHENYL 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 723619
Created by admin on Sat Dec 16 18:52:42 UTC 2023 , Edited by admin on Sat Dec 16 18:52:42 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID301275049
Created by admin on Sat Dec 16 18:52:42 UTC 2023 , Edited by admin on Sat Dec 16 18:52:42 UTC 2023
PRIMARY
PUBCHEM
102416
Created by admin on Sat Dec 16 18:52:42 UTC 2023 , Edited by admin on Sat Dec 16 18:52:42 UTC 2023
PRIMARY
CHEBI
90343
Created by admin on Sat Dec 16 18:52:42 UTC 2023 , Edited by admin on Sat Dec 16 18:52:42 UTC 2023
PRIMARY
FDA UNII
GVY9AA7Y5C
Created by admin on Sat Dec 16 18:52:42 UTC 2023 , Edited by admin on Sat Dec 16 18:52:42 UTC 2023
PRIMARY
CAS
3459-18-5
Created by admin on Sat Dec 16 18:52:42 UTC 2023 , Edited by admin on Sat Dec 16 18:52:42 UTC 2023
PRIMARY
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