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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H44N2.C6H12O7
Molecular Weight 520.7427
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of OLEYLAMINOPROPYLAMINE GLUCONATE

SMILES

OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=O.CCCCCCCC\C=C/CCCCCCCCNCCCN

InChI

InChIKey=ORWKHGBQQYXYCX-AJYBJSBJSA-N
InChI=1S/C21H44N2.C6H12O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-21-18-19-22;7-1-2(8)3(9)4(10)5(11)6(12)13/h9-10,23H,2-8,11-22H2,1H3;2-5,7-11H,1H2,(H,12,13)/b10-9-;/t;2-,3-,4+,5-/m.1/s1

HIDE SMILES / InChI

Molecular Formula C21H44N2
Molecular Weight 324.5875
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C6H12O7
Molecular Weight 196.1553
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:12:02 GMT 2023
Edited
by admin
on Sat Dec 16 08:12:02 GMT 2023
Record UNII
MS9T9E6DTF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OLEYLAMINOPROPYLAMINE GLUCONATE
Common Name English
D-GLUCONIC ACID N-OLEYL-1,3-PROPANEDIAMINE SALT
Systematic Name English
D-GLUCONIC ACID N-OLEYL-1,3-PROPANEDIAMINE SALT (1:1)
Systematic Name English
1,3-PROPANEDIAMINE, N-9-OCTADECENYL-, (Z)-, MONO-D-GLUCONATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00896804
Created by admin on Sat Dec 16 08:12:02 GMT 2023 , Edited by admin on Sat Dec 16 08:12:02 GMT 2023
PRIMARY
CAS
83542-86-3
Created by admin on Sat Dec 16 08:12:02 GMT 2023 , Edited by admin on Sat Dec 16 08:12:02 GMT 2023
PRIMARY
PUBCHEM
6435895
Created by admin on Sat Dec 16 08:12:02 GMT 2023 , Edited by admin on Sat Dec 16 08:12:02 GMT 2023
PRIMARY
FDA UNII
MS9T9E6DTF
Created by admin on Sat Dec 16 08:12:02 GMT 2023 , Edited by admin on Sat Dec 16 08:12:02 GMT 2023
PRIMARY