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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H21NO8
Molecular Weight 415.3933
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETOHYDROXAMIC ACID FLUOREN-2-YL-O-GLUCURONIDE

SMILES

CC(=O)N(O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C2=CC3=C(C=C2)C4=CC=CC=C4C3

InChI

InChIKey=VPBPTHOOANATTD-UNJWAJPSSA-N
InChI=1S/C21H21NO8/c1-10(23)22(30-21-18(26)16(24)17(25)19(29-21)20(27)28)13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9,16-19,21,24-26H,8H2,1H3,(H,27,28)/t16-,17-,18+,19-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H21NO8
Molecular Weight 415.3933
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 08:38:19 GMT 2023
Edited
by admin
on Sat Dec 16 08:38:19 GMT 2023
Record UNII
D1WO71B32M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETOHYDROXAMIC ACID FLUOREN-2-YL-O-GLUCURONIDE
Common Name English
N-HYDROXY-2-ACETYLAMINOFLUORENE O-GLUCURONIDE
Systematic Name English
CCRIS 4238
Common Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-O-(ACETYL-9H-FLUOREN-2-YLAMINO)-
Systematic Name English
N-HYDROXY-2-ACETYLAMINOFLUORENE GLUCURONIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
92183
Created by admin on Sat Dec 16 08:38:19 GMT 2023 , Edited by admin on Sat Dec 16 08:38:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID60179660
Created by admin on Sat Dec 16 08:38:19 GMT 2023 , Edited by admin on Sat Dec 16 08:38:19 GMT 2023
PRIMARY
CAS
2495-54-7
Created by admin on Sat Dec 16 08:38:19 GMT 2023 , Edited by admin on Sat Dec 16 08:38:19 GMT 2023
PRIMARY
FDA UNII
D1WO71B32M
Created by admin on Sat Dec 16 08:38:19 GMT 2023 , Edited by admin on Sat Dec 16 08:38:19 GMT 2023
PRIMARY