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Details

Stereochemistry ABSOLUTE
Molecular Formula C44H75N3O15S
Molecular Weight 918.142
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3'-N-DIDESMETHYL-3'-N-TOSYL AZITHROMYCIN

SMILES

CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@H](NS(=O)(=O)C4=CC=C(NC(C)=O)C=C4)[C@H]3O)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O

InChI

InChIKey=DBZCHNDJNSRJPU-RBQZDAPESA-N
InChI=1S/C44H75N3O15S/c1-14-33-44(11,54)37(50)27(6)47(12)22-23(2)20-42(9,53)39(25(4)36(26(5)40(52)60-33)61-34-21-43(10,57-13)38(51)28(7)59-34)62-41-35(49)32(19-24(3)58-41)46-63(55,56)31-17-15-30(16-18-31)45-29(8)48/h15-18,23-28,32-39,41,46,49-51,53-54H,14,19-22H2,1-13H3,(H,45,48)/t23-,24-,25+,26-,27-,28+,32+,33-,34+,35-,36+,37-,38+,39-,41+,42-,43-,44-/m1/s1

HIDE SMILES / InChI

Molecular Formula C44H75N3O15S
Molecular Weight 918.142
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 18 / 18
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 16:45:48 UTC 2023
Edited
by admin
on Thu Jul 06 16:45:48 UTC 2023
Record UNII
W26DEM4UN2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3'-N-DIDESMETHYL-3'-N-TOSYL AZITHROMYCIN
Common Name English
AZITHROMYCIN IMPURITY Q [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
139025245
Created by admin on Thu Jul 06 16:45:48 UTC 2023 , Edited by admin on Thu Jul 06 16:45:48 UTC 2023
PRIMARY
CAS
2095879-65-3
Created by admin on Thu Jul 06 16:45:48 UTC 2023 , Edited by admin on Thu Jul 06 16:45:48 UTC 2023
PRIMARY
FDA UNII
W26DEM4UN2
Created by admin on Thu Jul 06 16:45:48 UTC 2023 , Edited by admin on Thu Jul 06 16:45:48 UTC 2023
PRIMARY
Related Record Type Details
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