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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H37N5O8
Molecular Weight 571.6221
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-nitroso-desmethyl-omadacycline-1

SMILES

CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=C(CNCC(C)(C)C)C(O)=C4C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O)N(C)N=O

InChI

InChIKey=LBOPLFYMZVUZFT-ZSNWDDTMSA-N
InChI=1S/C28H37N5O8/c1-27(2,3)11-30-10-13-9-16(33(6)31-41)14-7-12-8-15-20(32(4)5)23(36)19(26(29)39)25(38)28(15,40)24(37)17(12)22(35)18(14)21(13)34/h9,12,15,20,30,34,36-37,40H,7-8,10-11H2,1-6H3,(H2,29,39)/t12-,15-,20-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H37N5O8
Molecular Weight 571.6221
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:25:02 GMT 2025
Edited
by admin
on Wed Apr 02 18:25:02 GMT 2025
Record UNII
EZL34US9VV
Record Status Validated (UNII)
Record Version
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Name Type Language
N-nitroso-desmethyl-omadacycline-1
Preferred Name English
Code System Code Type Description
FDA UNII
EZL34US9VV
Created by admin on Wed Apr 02 18:25:02 GMT 2025 , Edited by admin on Wed Apr 02 18:25:02 GMT 2025
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