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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H37FO11
Molecular Weight 568.5852
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEXAMETHASONE .BETA.-D-GLUCURONIDE

SMILES

[H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)[C@@]1(C)C[C@H](O)[C@@]4(F)[C@@]2([H])CCC5=CC(=O)C=C[C@]45C

InChI

InChIKey=UBHXMSIBGRGDSX-VFGCUDCLSA-N
InChI=1S/C28H37FO11/c1-12-8-16-15-5-4-13-9-14(30)6-7-25(13,2)27(15,29)17(31)10-26(16,3)28(12,38)18(32)11-39-24-21(35)19(33)20(34)22(40-24)23(36)37/h6-7,9,12,15-17,19-22,24,31,33-35,38H,4-5,8,10-11H2,1-3H3,(H,36,37)/t12-,15+,16+,17+,19+,20+,21-,22+,24-,25+,26+,27+,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula C28H37FO11
Molecular Weight 568.5852
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 13 / 13
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:33:57 GMT 2023
Edited
by admin
on Sat Dec 16 08:33:57 GMT 2023
Record UNII
1WOB7174M1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEXAMETHASONE .BETA.-D-GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (11.BETA.,16.ALPHA.)-9-FLUORO-11,17-DIHYDROXY-16-METHYL-3,20-DIOXOPREGNA-1,4-DIEN-21-YL
Systematic Name English
DEXAMETHASONE BETA-D-GLUCURONIDE
Common Name English
Code System Code Type Description
CAS
152154-28-4
Created by admin on Sat Dec 16 08:33:57 GMT 2023 , Edited by admin on Sat Dec 16 08:33:57 GMT 2023
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FDA UNII
1WOB7174M1
Created by admin on Sat Dec 16 08:33:57 GMT 2023 , Edited by admin on Sat Dec 16 08:33:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID80934435
Created by admin on Sat Dec 16 08:33:57 GMT 2023 , Edited by admin on Sat Dec 16 08:33:57 GMT 2023
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PUBCHEM
10099499
Created by admin on Sat Dec 16 08:33:57 GMT 2023 , Edited by admin on Sat Dec 16 08:33:57 GMT 2023
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