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Details

Stereochemistry RACEMIC
Molecular Formula C13H24O5
Molecular Weight 260.3267
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of 1-(ETHOXYCARBONYLOXY)ETHYL VALPROATE

SMILES

CCCC(CCC)C(=O)OC(C)OC(=O)OCC

InChI

InChIKey=ZIJGGSZJPPURSY-UHFFFAOYSA-N
InChI=1S/C13H24O5/c1-5-8-11(9-6-2)12(14)17-10(4)18-13(15)16-7-3/h10-11H,5-9H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C13H24O5
Molecular Weight 260.3267
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:11:10 UTC 2023
Edited
by admin
on Fri Dec 15 15:11:10 UTC 2023
Record UNII
D9VW6400WJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(ETHOXYCARBONYLOXY)ETHYL VALPROATE
Common Name English
VALDICE
Brand Name English
PENTANOIC ACID, 2-PROPYL-, 1-((ETHOXYCARBONYL)OXY)ETHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
D9VW6400WJ
Created by admin on Fri Dec 15 15:11:10 UTC 2023 , Edited by admin on Fri Dec 15 15:11:10 UTC 2023
PRIMARY
PUBCHEM
185249
Created by admin on Fri Dec 15 15:11:10 UTC 2023 , Edited by admin on Fri Dec 15 15:11:10 UTC 2023
PRIMARY
EPA CompTox
DTXSID70918628
Created by admin on Fri Dec 15 15:11:10 UTC 2023 , Edited by admin on Fri Dec 15 15:11:10 UTC 2023
PRIMARY
CAS
93181-78-3
Created by admin on Fri Dec 15 15:11:10 UTC 2023 , Edited by admin on Fri Dec 15 15:11:10 UTC 2023
PRIMARY
Related Record Type Details
METABOLITE ACTIVE -> PRODRUG
Related Record Type Details
ACTIVE MOIETY