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Details

Stereochemistry ABSOLUTE
Molecular Formula C36H65NO13
Molecular Weight 719.9002
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DEMETHYLERYTHROMYCIN A

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](NC)[C@H]3O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]2C

InChI

InChIKey=TXOOBKBDBNRQCF-QNPWSHAKSA-N
InChI=1S/C36H65NO13/c1-13-24-36(10,44)29(40)19(4)26(38)17(2)15-34(8,43)31(50-33-27(39)23(37-11)14-18(3)46-33)20(5)28(21(6)32(42)48-24)49-25-16-35(9,45-12)30(41)22(7)47-25/h17-25,27-31,33,37,39-41,43-44H,13-16H2,1-12H3/t17-,18-,19+,20+,21-,22+,23+,24-,25+,27-,28+,29-,30+,31-,33+,34-,35-,36-/m1/s1

HIDE SMILES / InChI

Molecular Formula C36H65NO13
Molecular Weight 719.9002
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 18 / 18
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:23:59 UTC 2023
Edited
by admin
on Fri Dec 15 17:23:59 UTC 2023
Record UNII
5CUO27O3DC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-DEMETHYLERYTHROMYCIN A
Common Name English
3''-N-DESMETHYLERYTHROMYCIN A
Common Name English
ERYTHROMYCIN, N-DEMETHYL-
Common Name English
DES-N-METHYLERYTHROMYCIN
Common Name English
DESMETHYLERYTHROMYCIN
Common Name English
CLARITHROMYCIN IMPURITY R
USP-RS  
Common Name English
CLARITHROMYCIN IMPURITY R [USP-RS]
Common Name English
ERYTHROMYCIN IMPURITY B [EP IMPURITY]
Common Name English
ERYTHROMYCIN ESTOLATE IMPURITY B [EP IMPURITY]
Common Name English
ERYTHROMYCIN RELATED COMPOUND N [USP-RS]
Common Name English
Code System Code Type Description
PUBCHEM
10010092
Created by admin on Fri Dec 15 17:24:00 UTC 2023 , Edited by admin on Fri Dec 15 17:24:00 UTC 2023
PRIMARY
RS_ITEM_NUM
1134642
Created by admin on Fri Dec 15 17:24:00 UTC 2023 , Edited by admin on Fri Dec 15 17:24:00 UTC 2023
ALTERNATIVE
RS_ITEM_NUM
1242032
Created by admin on Fri Dec 15 17:24:00 UTC 2023 , Edited by admin on Fri Dec 15 17:24:00 UTC 2023
PRIMARY
FDA UNII
5CUO27O3DC
Created by admin on Fri Dec 15 17:24:00 UTC 2023 , Edited by admin on Fri Dec 15 17:24:00 UTC 2023
PRIMARY
CAS
992-62-1
Created by admin on Fri Dec 15 17:24:00 UTC 2023 , Edited by admin on Fri Dec 15 17:24:00 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP