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

Details

Stereochemistry MIXED
Molecular Formula C25H47O15S.Na
Molecular Weight 642.686
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM DECYLMALTOSIDE HYDROXYPROPYLSULFONATE

SMILES

[Na+].[H][C@]2(O[C@H]1[C@H](O)[C@@H](O)C(OCCCCCCCCCC)O[C@@H]1CO)O[C@H](COCC(O)CS([O-])(=O)=O)[C@@H](O)[C@H](O)[C@H]2O

InChI

InChIKey=ODMMJIXMVMLHAP-CFJPOQJHSA-M
InChI=1S/C25H48O15S.Na/c1-2-3-4-5-6-7-8-9-10-37-24-22(32)20(30)23(16(11-26)38-24)40-25-21(31)19(29)18(28)17(39-25)13-36-12-15(27)14-41(33,34)35;/h15-32H,2-14H2,1H3,(H,33,34,35);/q;+1/p-1/t15?,16-,17-,18-,19+,20-,21-,22-,23-,24?,25-;/m1./s1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C25H47O15S
Molecular Weight 619.697
Charge -1
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 9 / 11
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:34:09 GMT 2023
Edited
by admin
on Sat Dec 16 08:34:09 GMT 2023
Record UNII
U215U81KD2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM DECYLMALTOSIDE HYDROXYPROPYLSULFONATE
Common Name English
Code System Code Type Description
PUBCHEM
135390902
Created by admin on Sat Dec 16 08:34:09 GMT 2023 , Edited by admin on Sat Dec 16 08:34:09 GMT 2023
PRIMARY
FDA UNII
U215U81KD2
Created by admin on Sat Dec 16 08:34:09 GMT 2023 , Edited by admin on Sat Dec 16 08:34:09 GMT 2023
PRIMARY