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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H41O9.Na
Molecular Weight 520.5881
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of Pseudomonic Acid D Sodium

SMILES

[Na+].C[C@H](O)[C@H](C)[C@@H]1O[C@H]1C[C@H]2CO[C@@H](C\C(C)=C\C(=O)OCCCC\C=C\CCC([O-])=O)[C@H](O)[C@@H]2O

InChI

InChIKey=SMEUVQBMXYPYPL-JPZIBMRNSA-M
InChI=1S/C26H42O9.Na/c1-16(13-23(30)33-11-9-7-5-4-6-8-10-22(28)29)12-20-25(32)24(31)19(15-34-20)14-21-26(35-21)17(2)18(3)27;/h4,6,13,17-21,24-27,31-32H,5,7-12,14-15H2,1-3H3,(H,28,29);/q;+1/p-1/b6-4+,16-13+;/t17-,18-,19-,20-,21-,24+,25-,26-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C26H41O9
Molecular Weight 497.5983
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 2
Optical Activity UNSPECIFIED

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
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 Wed Apr 02 17:51:18 GMT 2025
Edited
by admin
on Wed Apr 02 17:51:18 GMT 2025
Record UNII
ZAL2PPL2SP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Pseudomonic Acid D Sodium
Common Name English
Mupirocin calcium EP impurity C sodium
Preferred Name English
Sodium pseudomonate D
Common Name English
L-talo-Non-2-enonic acid, 5,9-anhydro-2,3,4,8-tetradeoxy-8-[[3-(2-hydroxy-1-methylpropyl)oxiranyl]methyl]-3-methyl-, 8-carboxy-5-octenyl ester, monosodium salt, [1(E),2E,8[2S,3S(1S,2S)]]-
Systematic Name English
Code System Code Type Description
FDA UNII
ZAL2PPL2SP
Created by admin on Wed Apr 02 17:51:18 GMT 2025 , Edited by admin on Wed Apr 02 17:51:18 GMT 2025
PRIMARY
CAS
85178-60-5
Created by admin on Wed Apr 02 17:51:18 GMT 2025 , Edited by admin on Wed Apr 02 17:51:18 GMT 2025
PRIMARY
EPA CompTox
DTXSID10858352
Created by admin on Wed Apr 02 17:51:18 GMT 2025 , Edited by admin on Wed Apr 02 17:51:18 GMT 2025
PRIMARY
PUBCHEM
71751871
Created by admin on Wed Apr 02 17:51:18 GMT 2025 , Edited by admin on Wed Apr 02 17:51:18 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE