Erythromycin, 8,9-didehydro-9-deoxo-6-deoxy-6,9-epoxy-, (9S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C37H65NO12
Molecular Weight	715.9115
Optical Activity	UNSPECIFIED
Defined Stereocenters	17 / 17
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Erythromycin, 8,9-didehydro-9-deoxo-6-deoxy-6,9-epoxy-, (9S)-

Structure Search

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]([C@H]3O)N(C)C)[C@]4(C)CC(C)=C(O4)[C@H](C)[C@@H](O)[C@]1(C)O

InChI

InChIKey=JFVYXJKGJMUGRG-MGSLXKPGSA-N

InChI=1S/C37H65NO12/c1-14-25-37(10,43)30(40)20(4)28-18(2)16-36(9,50-28)32(49-34-27(39)24(38(11)12)15-19(3)45-34)21(5)29(22(6)33(42)47-25)48-26-17-35(8,44-13)31(41)23(7)46-26/h19-27,29-32,34,39-41,43H,14-17H2,1-13H3/t19-,20+,21+,22-,23+,24+,25-,26+,27-,29+,30-,31+,32-,34+,35-,36+,37-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C37H65NO12
Molecular Weight	715.9115
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	17 / 17
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:21:33 GMT 2025` Edited by `admin` on `Wed Apr 02 17:21:33 GMT 2025`
Record UNII	Q225NZM7BP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Erythromycin Impurity E

Preferred Name

English

Erythromycin, 8,9-didehydro-9-deoxo-6-deoxy-6,9-epoxy-, (9S)-

Systematic Name

English

(2R,3R,4S,5R,8R,9S,10S,11R,12S)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-ethyl-3,4-dihydroxy-9-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-6,15-dioxabicyclo[10.2.1]pentadec-1(14)-en-

Systematic Name

English

Code System Code Type Description

CAS

857839-61-3

Created by admin on Wed Apr 02 17:21:33 GMT 2025 , Edited by admin on Wed Apr 02 17:21:33 GMT 2025

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FDA UNII

Q225NZM7BP

Created by admin on Wed Apr 02 17:21:33 GMT 2025 , Edited by admin on Wed Apr 02 17:21:33 GMT 2025

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PUBCHEM

13041195

Created by admin on Wed Apr 02 17:21:33 GMT 2025 , Edited by admin on Wed Apr 02 17:21:33 GMT 2025

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