U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C40H70O13
Molecular Weight 758.976
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIPENTAERYTHRITYL HEXAPENTANOATE

SMILES

CCCCC(=O)OCC(COCC(COC(=O)CCCC)(COC(=O)CCCC)COC(=O)CCCC)(COC(=O)CCCC)COC(=O)CCCC

InChI

InChIKey=DARZXIQICMMEHI-UHFFFAOYSA-N
InChI=1S/C40H70O13/c1-7-13-19-33(41)48-27-39(28-49-34(42)20-14-8-2,29-50-35(43)21-15-9-3)25-47-26-40(30-51-36(44)22-16-10-4,31-52-37(45)23-17-11-5)32-53-38(46)24-18-12-6/h7-32H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C40H70O13
Molecular Weight 758.976
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 Mon Mar 31 21:09:51 GMT 2025
Edited
by admin
on Mon Mar 31 21:09:51 GMT 2025
Record UNII
6O6AB689W4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIPENTAERYTHRITYL HEXA C5 ACID ESTERS
Preferred Name English
DIPENTAERYTHRITYL HEXAPENTANOATE
Common Name English
PENTANOIC ACID, 1,1'-(OXYBIS(2,2-BIS(((1-OXOPENTYL)OXY)METHYL)-1,3-PROPANEDIYL)) ESTER
Common Name English
PENTANOIC ACID, OXYBIS(2,2-BIS(((1-OXOPENTYL)OXY)METHYL)-1,3-PROPANEDIYL) ESTER
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID20227050
Created by admin on Mon Mar 31 21:09:51 GMT 2025 , Edited by admin on Mon Mar 31 21:09:51 GMT 2025
PRIMARY
PUBCHEM
13628813
Created by admin on Mon Mar 31 21:09:51 GMT 2025 , Edited by admin on Mon Mar 31 21:09:51 GMT 2025
PRIMARY
FDA UNII
6O6AB689W4
Created by admin on Mon Mar 31 21:09:51 GMT 2025 , Edited by admin on Mon Mar 31 21:09:51 GMT 2025
PRIMARY
CAS
76185-96-1
Created by admin on Mon Mar 31 21:09:51 GMT 2025 , Edited by admin on Mon Mar 31 21:09:51 GMT 2025
PRIMARY