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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H16BNO4.ClH
Molecular Weight 273.521
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EPETRABOROLE HYDROCHLORIDE

SMILES

Cl.NC[C@H]1OB(O)C2=C1C=CC=C2OCCCO

InChI

InChIKey=DADYQGIQOBJGIW-HNCPQSOCSA-N
InChI=1S/C11H16BNO4.ClH/c13-7-10-8-3-1-4-9(16-6-2-5-14)11(8)12(15)17-10;/h1,3-4,10,14-15H,2,5-7,13H2;1H/t10-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C11H16BNO4
Molecular Weight 237.06
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:19:41 UTC 2023
Edited
by admin
on Sat Dec 16 01:19:41 UTC 2023
Record UNII
MM0NZY12FA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EPETRABOROLE HYDROCHLORIDE
WHO-DD  
Common Name English
1-PROPANOL, 3-(((3S)-3-(AMINOMETHYL)-1,3-DIHYDRO-1-HYDROXY-2,1-BENZOXABOROL-7-YL)OXY)-, HYDROCHLORIDE (1:1)
Systematic Name English
Epetraborole hydrochloride [WHO-DD]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 860621
Created by admin on Sat Dec 16 01:19:42 UTC 2023 , Edited by admin on Sat Dec 16 01:19:42 UTC 2023
Code System Code Type Description
CAS
1234563-16-6
Created by admin on Sat Dec 16 01:19:41 UTC 2023 , Edited by admin on Sat Dec 16 01:19:41 UTC 2023
PRIMARY
DRUG BANK
DBSALT002062
Created by admin on Sat Dec 16 01:19:42 UTC 2023 , Edited by admin on Sat Dec 16 01:19:42 UTC 2023
PRIMARY
PUBCHEM
52918389
Created by admin on Sat Dec 16 01:19:42 UTC 2023 , Edited by admin on Sat Dec 16 01:19:42 UTC 2023
PRIMARY
FDA UNII
MM0NZY12FA
Created by admin on Sat Dec 16 01:19:42 UTC 2023 , Edited by admin on Sat Dec 16 01:19:42 UTC 2023
PRIMARY
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