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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H19FO9
Molecular Weight 422.3579
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NW-1689 AG

SMILES

O[C@@H]1[C@@H](O)[C@H](OC(=O)C2=CC=C(OCC3=CC=CC(F)=C3)C=C2)O[C@@H]([C@H]1O)C(O)=O

InChI

InChIKey=VGDOWGNYJPDWKQ-GHHWKCCRSA-N
InChI=1S/C20H19FO9/c21-12-3-1-2-10(8-12)9-28-13-6-4-11(5-7-13)19(27)30-20-16(24)14(22)15(23)17(29-20)18(25)26/h1-8,14-17,20,22-24H,9H2,(H,25,26)/t14-,15-,16+,17-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H19FO9
Molecular Weight 422.3579
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 13:46:06 UTC 2023
Edited
by admin
on Sat Dec 16 13:46:06 UTC 2023
Record UNII
C2GYP7EAW8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NW-1689 AG
Code English
MSC2357341A
Code English
NW-1689 1.BETA.-O-ACYLGLUCURONIDE
Code English
NW-1689-ACYLGLUCURONIDE
Code English
M422
Code English
NW-1689 ACYLGLUCURONIDE
Code English
(2S,3S,4S,5R,6S)-6-((4-((3-FLUOROBENZYL)OXY)BENZOYL)OXY)-3,4,5-TRIHYDROXYTETRAHYDRO-2H-PYRAN-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
156613604
Created by admin on Sat Dec 16 13:46:06 UTC 2023 , Edited by admin on Sat Dec 16 13:46:06 UTC 2023
PRIMARY
FDA UNII
C2GYP7EAW8
Created by admin on Sat Dec 16 13:46:06 UTC 2023 , Edited by admin on Sat Dec 16 13:46:06 UTC 2023
PRIMARY
Related Record Type Details
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