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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H26FN3O3
Molecular Weight 363.4264
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0
Stereo Comments assumed S-isomer

SHOW SMILES / InChI
Structure of 4F-MDMB-BINACA

SMILES

COC(=O)[C@@H](NC(=O)C1=NN(CCCCF)C2=C1C=CC=C2)C(C)(C)C

InChI

InChIKey=GZGKSDAMWRWYOZ-MRXNPFEDSA-N
InChI=1S/C19H26FN3O3/c1-19(2,3)16(18(25)26-4)21-17(24)15-13-9-5-6-10-14(13)23(22-15)12-8-7-11-20/h5-6,9-10,16H,7-8,11-12H2,1-4H3,(H,21,24)/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H26FN3O3
Molecular Weight 363.4264
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 21:03:15 UTC 2023
Edited
by admin
on Thu Jul 06 21:03:15 UTC 2023
Record UNII
ZH38UTM145
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4F-MDMB-BINACA
Common Name English
4F-MDMB-BINACA [NFLIS-DRUG]
Common Name English
L-VALINE, N-((1-(4-FLUOROBUTYL)-1H-INDAZOL-3-YL)CARBONYL)-3-METHYL-, METHYL ESTER
Systematic Name English
4-FLUORO-MDMB-BINACA
Common Name English
4F-ADB
Common Name English
METHYL (S)-2-(1-(4-FLUOROBUTYL)-1H-INDAZOLE-3-CARBOXAMIDO)-3,3-DIMETHYLBUTANOATE
Systematic Name English
Classification Tree Code System Code
WIKIPEDIA Designer-drugs-4F-MDMB-BINACA
Created by admin on Thu Jul 06 21:03:15 UTC 2023 , Edited by admin on Thu Jul 06 21:03:15 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID001017266
Created by admin on Thu Jul 06 21:03:15 UTC 2023 , Edited by admin on Thu Jul 06 21:03:15 UTC 2023
PRIMARY
PUBCHEM
155490546
Created by admin on Thu Jul 06 21:03:15 UTC 2023 , Edited by admin on Thu Jul 06 21:03:15 UTC 2023
PRIMARY PUBCHEM
FDA UNII
ZH38UTM145
Created by admin on Thu Jul 06 21:03:15 UTC 2023 , Edited by admin on Thu Jul 06 21:03:15 UTC 2023
PRIMARY
CAS
2390036-46-9
Created by admin on Thu Jul 06 21:03:15 UTC 2023 , Edited by admin on Thu Jul 06 21:03:15 UTC 2023
PRIMARY
SMS_ID
300000025705
Created by admin on Thu Jul 06 21:03:15 UTC 2023 , Edited by admin on Thu Jul 06 21:03:15 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
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METABOLITE -> PARENT
METABOLITE -> PARENT
METABOLITE -> PARENT
METABOLITE -> PARENT
METABOLITE -> PARENT
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ACTIVE MOIETY