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Details

Stereochemistry ABSOLUTE
Molecular Formula C45H77N3O15S
Molecular Weight 932.169
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3'-N-((4-(ACETYLAMINO)PHENYL)SULFONYL)-3'-N-DEMETHYLAZITHROMYCIN

SMILES

[H][C@@]1(C[C@@](C)(OC)[C@@H](O)[C@H](C)O1)O[C@H]2[C@H](C)[C@@H](O[C@]3([H])O[C@H](C)C[C@@H]([C@H]3O)N(C)S(=O)(=O)C4=CC=C(NC(C)=O)C=C4)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]2C

InChI

InChIKey=UXWVLGKGQGGAID-SYARVETMSA-N
InChI=1S/C45H77N3O15S/c1-15-34-45(11,55)38(51)28(6)47(12)23-24(2)21-43(9,54)40(26(4)37(27(5)41(53)61-34)62-35-22-44(10,58-14)39(52)29(7)60-35)63-42-36(50)33(20-25(3)59-42)48(13)64(56,57)32-18-16-31(17-19-32)46-30(8)49/h16-19,24-29,33-40,42,50-52,54-55H,15,20-23H2,1-14H3,(H,46,49)/t24-,25-,26+,27-,28-,29+,33+,34-,35+,36-,37+,38-,39+,40-,42+,43-,44-,45-/m1/s1

HIDE SMILES / InChI

Molecular Formula C45H77N3O15S
Molecular Weight 932.169
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 Sat Dec 16 07:01:23 UTC 2023
Edited
by admin
on Sat Dec 16 07:01:23 UTC 2023
Record UNII
GY11I2897O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3'-N-((4-(ACETYLAMINO)PHENYL)SULFONYL)-3'-N-DEMETHYLAZITHROMYCIN
Common Name English
AZITHROMYCIN RELATED COMPOUND H
USP-RS  
Common Name English
AZITHROMYCIN RELATED COMPOUND H [USP-RS]
Common Name English
AZITHROMYCIN IMPURITY H [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
71312817
Created by admin on Sat Dec 16 07:01:23 UTC 2023 , Edited by admin on Sat Dec 16 07:01:23 UTC 2023
PRIMARY
FDA UNII
GY11I2897O
Created by admin on Sat Dec 16 07:01:23 UTC 2023 , Edited by admin on Sat Dec 16 07:01:23 UTC 2023
PRIMARY
CAS
612069-30-4
Created by admin on Sat Dec 16 07:01:23 UTC 2023 , Edited by admin on Sat Dec 16 07:01:23 UTC 2023
PRIMARY
EPA CompTox
DTXSID00210127
Created by admin on Sat Dec 16 07:01:23 UTC 2023 , Edited by admin on Sat Dec 16 07:01:23 UTC 2023
PRIMARY
RS_ITEM_NUM
1046023
Created by admin on Sat Dec 16 07:01:23 UTC 2023 , Edited by admin on Sat Dec 16 07:01:23 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
For the calculation of content, multiply the peak area by 0.1
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP