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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28FN3O3
Molecular Weight 377.453
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5F-MDMB-P7AICA

SMILES

COC(=O)[C@@H](NC(=O)C1=CN(CCCCCF)C2=C1C=CC=N2)C(C)(C)C

InChI

InChIKey=LIRBKFHBIDESHO-MRXNPFEDSA-N
InChI=1S/C20H28FN3O3/c1-20(2,3)16(19(26)27-4)23-18(25)15-13-24(12-7-5-6-10-21)17-14(15)9-8-11-22-17/h8-9,11,13,16H,5-7,10,12H2,1-4H3,(H,23,25)/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H28FN3O3
Molecular Weight 377.453
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 Sat Dec 16 18:09:33 UTC 2023
Edited
by admin
on Sat Dec 16 18:09:33 UTC 2023
Record UNII
B2U5NV8ZMN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5F-MDMB-P7AICA
Common Name English
L-VALINE, N-((1-(5-FLUOROPENTYL)-1H-PYRROLO(2,3-B)PYRIDIN-3-YL)CARBONYL)-3-METHYL-, METHYL ESTER
Systematic Name English
N-[[1-(5-Fluoropentyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]-3-methyl-L-valine methyl ester
Systematic Name English
Code System Code Type Description
PUBCHEM
165361518
Created by admin on Sat Dec 16 18:09:33 UTC 2023 , Edited by admin on Sat Dec 16 18:09:33 UTC 2023
PRIMARY
CAS
2377403-81-9
Created by admin on Sat Dec 16 18:09:33 UTC 2023 , Edited by admin on Sat Dec 16 18:09:33 UTC 2023
PRIMARY
FDA UNII
B2U5NV8ZMN
Created by admin on Sat Dec 16 18:09:33 UTC 2023 , Edited by admin on Sat Dec 16 18:09:33 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Emax=142% relative to JWH-018
EC50
Related Record Type Details
ACTIVE MOIETY