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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H35ClN2O6S
Molecular Weight 455.009
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of U-34728E FREE BASE

SMILES

CCC[C@@H]1C[C@H](N(CCO)C1)C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O

InChI

InChIKey=CDTZISBEQQFYAY-YLKLGEPYSA-N
InChI=1S/C19H35ClN2O6S/c1-4-5-11-8-12(22(9-11)6-7-23)18(27)21-13(10(2)20)17-15(25)14(24)16(26)19(28-17)29-3/h10-17,19,23-26H,4-9H2,1-3H3,(H,21,27)/t10-,11+,12-,13+,14-,15+,16+,17+,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H35ClN2O6S
Molecular Weight 455.009
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 23:45:20 GMT 2025
Edited
by admin
on Tue Apr 01 23:45:20 GMT 2025
Record UNII
82Q61HT6VI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
U-34728E FREE BASE
Code English
L-THREO-.ALPHA.-D-GALACTO-OCTOPYRANOSIDE, METHYL 7-CHLORO-6,7,8-TRIDEOXY-6-((((2S,4R)-1-(2-HYDROXYETHYL)-4-PROPYL-2-PYRROLIDINYL)CARBONYL)AMINO)-1-THIO-
Preferred Name English
Code System Code Type Description
FDA UNII
82Q61HT6VI
Created by admin on Tue Apr 01 23:45:20 GMT 2025 , Edited by admin on Tue Apr 01 23:45:20 GMT 2025
PRIMARY
CAS
40984-87-0
Created by admin on Tue Apr 01 23:45:20 GMT 2025 , Edited by admin on Tue Apr 01 23:45:20 GMT 2025
PRIMARY
PUBCHEM
133082159
Created by admin on Tue Apr 01 23:45:20 GMT 2025 , Edited by admin on Tue Apr 01 23:45:20 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT