U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H28N2O3
Molecular Weight 344.4479
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MMB-018

SMILES

CCCCCN1C=C(C(=O)N[C@@H](C(C)C)C(=O)OC)C2=C1C=CC=C2

InChI

InChIKey=XOVHYVWQBVNONJ-SFHVURJKSA-N
InChI=1S/C20H28N2O3/c1-5-6-9-12-22-13-16(15-10-7-8-11-17(15)22)19(23)21-18(14(2)3)20(24)25-4/h7-8,10-11,13-14,18H,5-6,9,12H2,1-4H3,(H,21,23)/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H28N2O3
Molecular Weight 344.4479
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Pharmacology of Valinate and tert-Leucinate Synthetic Cannabinoids 5F-AMBICA, 5F-AMB, 5F-ADB, AMB-FUBINACA, MDMB-FUBINACA, MDMB-CHMICA, and Their Analogues.
2016 Sep 21
Substance Class Chemical
Created
by admin
on Sat Dec 16 18:36:08 UTC 2023
Edited
by admin
on Sat Dec 16 18:36:08 UTC 2023
Record UNII
2V3HAX6RM7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MMB-018
Code English
MMB018
Code English
N-((1-PENTYL-1H-INDOL-3-YL)CARBONYL)-L-VALINE METHYL ESTER
Common Name English
L-VALINE, N-((1-PENTYL-1H-INDOL-3-YL)CARBONYL)-, METHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
2V3HAX6RM7
Created by admin on Sat Dec 16 18:36:09 UTC 2023 , Edited by admin on Sat Dec 16 18:36:09 UTC 2023
PRIMARY
CAS
1971007-97-2
Created by admin on Sat Dec 16 18:36:09 UTC 2023 , Edited by admin on Sat Dec 16 18:36:09 UTC 2023
PRIMARY
PUBCHEM
125181439
Created by admin on Sat Dec 16 18:36:09 UTC 2023 , Edited by admin on Sat Dec 16 18:36:09 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY