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Details

Stereochemistry ACHIRAL
Molecular Formula C18H32O6
Molecular Weight 344.4431
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIISOVALERIN

SMILES

CC(C)CC(=O)OCC(COC(=O)CC(C)C)OC(=O)CC(C)C

InChI

InChIKey=HZGMZSCMYSGJTL-UHFFFAOYSA-N
InChI=1S/C18H32O6/c1-12(2)7-16(19)22-10-15(24-18(21)9-14(5)6)11-23-17(20)8-13(3)4/h12-15H,7-11H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C18H32O6
Molecular Weight 344.4431
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:50:59 GMT 2023
Edited
by admin
on Fri Dec 15 19:50:59 GMT 2023
Record UNII
451HEL00B1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRIISOVALERIN
Common Name English
GLYCEROL TRIISOVALERATE
Systematic Name English
NSC-4048
Code English
Code System Code Type Description
PUBCHEM
69285
Created by admin on Fri Dec 15 19:50:59 GMT 2023 , Edited by admin on Fri Dec 15 19:50:59 GMT 2023
PRIMARY
FDA UNII
451HEL00B1
Created by admin on Fri Dec 15 19:50:59 GMT 2023 , Edited by admin on Fri Dec 15 19:50:59 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-645-1
Created by admin on Fri Dec 15 19:50:59 GMT 2023 , Edited by admin on Fri Dec 15 19:50:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID5060720
Created by admin on Fri Dec 15 19:50:59 GMT 2023 , Edited by admin on Fri Dec 15 19:50:59 GMT 2023
PRIMARY
NSC
4048
Created by admin on Fri Dec 15 19:50:59 GMT 2023 , Edited by admin on Fri Dec 15 19:50:59 GMT 2023
PRIMARY
CAS
620-63-3
Created by admin on Fri Dec 15 19:50:59 GMT 2023 , Edited by admin on Fri Dec 15 19:50:59 GMT 2023
PRIMARY