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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H24N2O4.ClH
Molecular Weight 344.834
Optical Activity ( - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of UBENIMEX HYDROCHLORIDE

SMILES

Cl.CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)CC1=CC=CC=C1)C(O)=O

InChI

InChIKey=XGDFITZJGKUSDK-UDYGKFQRSA-N
InChI=1S/C16H24N2O4.ClH/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11;/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22);1H/t12-,13+,14+;/m1./s1

HIDE SMILES / InChI

Molecular Formula C16H24N2O4
Molecular Weight 308.3728
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
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 08:48:37 UTC 2023
Edited
by admin
on Sat Dec 16 08:48:37 UTC 2023
Record UNII
BY7Y2JX7NQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
UBENIMEX HYDROCHLORIDE
Common Name English
L-LEUCINE, N-((2S,3R)-3-AMINO-2-HYDROXY-1-OXO-4-PHENYLBUTYL)-, MONOHYDROCHLORIDE
Systematic Name English
BESTATIN HYDROCHLORIDE
Common Name English
(-)-BESTATIN HYDROCHLORIDE
Common Name English
L-LEUCINE, N-((2S,3R)-3-AMINO-2-HYDROXY-1-OXO-4-PHENYLBUTYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
DRUG BANK
DBSALT002908
Created by admin on Sat Dec 16 08:48:37 UTC 2023 , Edited by admin on Sat Dec 16 08:48:37 UTC 2023
PRIMARY
CAS
65391-42-6
Created by admin on Sat Dec 16 08:48:37 UTC 2023 , Edited by admin on Sat Dec 16 08:48:37 UTC 2023
PRIMARY
EPA CompTox
DTXSID0045759
Created by admin on Sat Dec 16 08:48:37 UTC 2023 , Edited by admin on Sat Dec 16 08:48:37 UTC 2023
PRIMARY
PUBCHEM
11957481
Created by admin on Sat Dec 16 08:48:37 UTC 2023 , Edited by admin on Sat Dec 16 08:48:37 UTC 2023
PRIMARY
FDA UNII
BY7Y2JX7NQ
Created by admin on Sat Dec 16 08:48:37 UTC 2023 , Edited by admin on Sat Dec 16 08:48:37 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE