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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H24O8
Molecular Weight 320.3356
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VALPROATE GLUCURONIDE

SMILES

CCCC(CCC)C(=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O

InChI

InChIKey=XXKSYIHWRBBHIC-JVWRJRKNSA-N
InChI=1S/C14H24O8/c1-3-5-7(6-4-2)13(20)22-14-10(17)8(15)9(16)11(21-14)12(18)19/h7-11,14-17H,3-6H2,1-2H3,(H,18,19)/t8-,9-,10+,11-,14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H24O8
Molecular Weight 320.3356
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 13:44:26 GMT 2023
Edited
by admin
on Sat Dec 16 13:44:26 GMT 2023
Record UNII
SB05J7266C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VALPROATE GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-(2-PROPYLPENTANOATE)
Systematic Name English
1-O-VALPROYL-.BETA.-D-GLUCOPYRANURONIC ACID
Common Name English
VPA-G
Common Name English
DIPROPYLACETATE GLUCURONIDE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID901311881
Created by admin on Sat Dec 16 13:44:27 GMT 2023 , Edited by admin on Sat Dec 16 13:44:27 GMT 2023
PRIMARY
CAS
60113-83-9
Created by admin on Sat Dec 16 13:44:27 GMT 2023 , Edited by admin on Sat Dec 16 13:44:27 GMT 2023
PRIMARY
PUBCHEM
88111
Created by admin on Sat Dec 16 13:44:27 GMT 2023 , Edited by admin on Sat Dec 16 13:44:27 GMT 2023
PRIMARY
FDA UNII
SB05J7266C
Created by admin on Sat Dec 16 13:44:27 GMT 2023 , Edited by admin on Sat Dec 16 13:44:27 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE